data_1s62_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 1s62 _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 ' 16' ' ' ILE . . . . . . . . . . . . . 2.5 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.981 0.42 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -62.91 -26.88 69.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.91 178.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.256 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.07 -31.11 69.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.469 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.31 64.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.288 0.566 . . . . 0.0 109.879 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.21 -32.28 72.39 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.833 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.45 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -60.06 -30.16 69.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.98 0.39 . . . . 0.0 110.894 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.541 ' O ' HG13 ' A' ' 27' ' ' ILE . 2.6 mt -76.36 -35.12 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.024 0.44 . . . . 0.0 109.954 176.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -62.28 -46.53 88.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.002 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.0 -34.46 75.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.232 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.39 -32.45 72.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.391 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 23' ' ' ILE . 8.5 mt -67.97 -32.81 57.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.707 -176.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.402 ' C ' ' H ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -65.15 -40.08 93.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.639 0.257 . . . . 0.0 111.208 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.41 14.13 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -119.26 -8.55 10.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 176.978 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.429 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.723 176.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.461 0.081 0 CA-C-O 120.895 0.379 . . . . 0.0 110.876 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -141.14 139.66 33.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.785 176.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 52.8 t -138.05 79.6 1.75 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.47 0.652 . . . . 0.0 110.823 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -70.14 120.99 16.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.012 176.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 59' ' ' PRO . 67.0 mt -113.64 124.56 52.62 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.91 0.386 . . . . 0.0 110.666 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.529 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -81.02 88.17 5.96 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.481 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.3 pt -113.89 152.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.447 -174.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.582 ' HB2' ' HB2' ' A' ' 56' ' ' ASP . 5.0 mtmt -140.33 112.62 7.81 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.375 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 2.3 tp -95.55 118.65 32.65 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 120.915 0.388 . . . . 0.0 110.952 -177.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.425 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -67.57 159.05 80.47 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.979 176.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.48 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 37.4 Cg_exo -57.04 -15.91 19.15 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.864 2.376 . . . . 0.0 112.777 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.83 -0.93 57.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.327 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.52 52.94 4.89 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.52 -0.848 . . . . 0.0 112.426 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.71 140.61 23.78 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.416 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -86.16 107.54 17.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.006 0.431 . . . . 0.0 110.657 -178.722 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.425 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -76.6 -37.37 56.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.902 177.54 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.582 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -112.7 140.15 47.72 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.885 178.723 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -158.82 106.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.364 0.602 . . . . 0.0 110.128 177.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.404 ' HG3' ' HD2' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -140.43 127.05 12.02 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.191 -175.463 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.462 ' HA ' HD22 ' A' ' 44' ' ' LEU . 64.1 Cg_endo -76.62 111.08 3.18 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.701 2.267 . . . . 0.0 112.422 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -124.17 21.46 8.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.736 0.779 . . . . 0.0 109.957 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.433 ' HA2' ' HB ' ' A' ' 43' ' ' THR . . . -79.81 -151.84 7.04 Favored Glycine 0 C--N 1.32 -0.345 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.368 -177.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -115.85 -13.02 8.87 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.822 -0.704 . . . . 0.0 113.2 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -117.63 112.46 38.93 Favored Pre-proline 0 C--N 1.327 -0.403 0 O-C-N 122.551 -0.381 . . . . 0.0 110.466 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.445 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 36.7 Cg_endo -68.96 -27.38 30.43 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.691 2.261 . . . . 0.0 112.886 -176.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -77.71 -51.74 10.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.735 0.302 . . . . 0.0 110.85 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.8 tp -56.87 -44.05 81.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.387 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.612 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.2 m -69.76 -38.89 76.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.914 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.445 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 1.3 mp0 -62.18 -40.83 97.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.011 0.434 . . . . 0.0 110.888 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.72 55.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.032 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.62 -37.94 76.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.812 -178.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 22.0 mt -55.3 -44.03 75.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.771 0.32 . . . . 0.0 111.198 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.41 46.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.267 -178.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.83 91.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.554 -177.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.33 79.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 111.196 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.007 0.432 . . . . 0.0 110.967 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 mt -92.27 -3.6 55.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.694 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -80.08 168.3 19.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -100.56 106.63 18.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 110.906 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mp -119.35 116.89 33.44 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.104 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -78.96 172.44 14.95 Favored 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 122.733 2.289 . . . . 0.0 113.066 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 124.33 89.78 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.195 178.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 68.7 Cg_exo -53.61 114.99 2.02 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.236 2.624 . . . . 0.0 112.646 -178.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 7.2 Cg_endo -92.14 -75.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.351 2.701 . . . . 0.0 112.903 -174.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.35 134.63 56.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.804 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.77 -36.48 74.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.49 -176.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.01 -47.36 83.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.829 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 83.7 t -66.72 -43.62 89.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.441 178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.48 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 6.1 t80 -60.87 -41.58 96.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.116 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.441 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 16.4 mm-40 -62.92 -24.77 68.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 0.0 111.234 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 93.3 t -92.43 -45.01 14.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.624 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.414 ' HD1' ' HA ' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -59.95 -30.47 69.1 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -175.228 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 48' ' ' LEU . 3.1 ptpt -66.27 -8.22 23.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.731 0.3 . . . . 0.0 111.602 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -164.38 59.94 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.914 0.387 . . . . 0.0 110.114 176.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.75 89.2 22.72 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.171 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.529 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 2.3 Cg_endo -76.1 103.14 1.69 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.07 1.847 . . . . 0.0 110.399 175.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.0 mt -102.75 153.24 20.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.973 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.544 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -94.38 132.35 39.1 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.023 175.121 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.601 ' O ' ' HB3' ' A' ' 42' ' ' CYS . 82.4 m-85 -113.98 98.92 7.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.473 0.654 . . . . 0.0 110.075 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.653 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -112.23 173.99 2.57 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.608 177.822 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.653 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 35.5 Cg_exo . . . . . 0 C--N 1.356 0.952 0 C-N-CA 123.092 2.528 . . . . 0.0 112.855 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.134 0 CA-C-O 120.675 0.274 . . . . 0.0 111.121 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.32 -29.84 71.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.623 -177.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -62.37 -46.22 89.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.875 0.369 . . . . 0.0 110.741 178.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.68 -28.91 51.2 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.831 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.63 -35.99 82.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 110.33 175.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.1 -33.88 84.71 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.796 177.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -45.72 92.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.2 mt -64.82 -45.68 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.798 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -60.33 -35.92 76.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.016 0.436 . . . . 0.0 110.948 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -72.81 -40.55 65.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.5 -38.48 77.74 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.739 0.78 . . . . 0.0 110.631 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.507 HD11 HG21 ' A' ' 27' ' ' ILE . 8.5 mt -66.04 -43.44 92.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.262 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.12 -22.12 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -178.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -26.21 60.78 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.839 177.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.419 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.32 -51.9 7.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.891 174.757 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-O 121.057 0.456 . . . . 0.0 110.006 177.095 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.827 0.346 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.18 156.78 44.73 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.287 176.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.697 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 8.2 t -142.52 151.39 41.58 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.0 m -125.16 103.23 7.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.218 0.532 . . . . 0.0 110.907 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.475 HD11 ' HB1' ' A' ' 70' ' ' ALA . 63.8 mt -92.59 113.18 25.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.009 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.723 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.3 mmt-85 -81.73 88.17 6.29 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.2 pt -101.04 151.74 5.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.074 -174.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.534 ' HE2' ' HB3' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -134.7 89.17 2.51 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.92 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.582 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 1.6 tp -80.74 123.2 28.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.393 -172.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.48 ' HB3' HD22 ' A' ' 55' ' ' LEU . . . -74.31 152.29 87.95 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 173.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -57.37 -16.4 22.76 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.053 2.502 . . . . 0.0 112.58 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.88 -14.34 62.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.723 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.05 59.94 2.23 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.807 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.97 146.11 20.21 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.36 82.1 2.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.321 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.48 HD22 ' HB3' ' A' ' 49' ' ' ALA . 0.2 OUTLIER -73.9 -19.57 60.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 177.801 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.438 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -125.05 117.26 23.57 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.488 177.391 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.5 tt -159.46 111.03 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.499 . . . . 0.0 110.531 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.482 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -137.74 135.05 18.58 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.183 -177.238 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.721 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 2.0 Cg_endo -80.64 74.36 5.58 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.414 2.743 . . . . 0.0 111.308 177.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.575 ' HB2' ' HG3' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -65.37 -34.15 77.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.081 -175.503 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -144.16 163.38 27.77 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.099 177.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.671 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 109.84 179.77 20.83 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.181 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.11 123.41 87.22 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-O 120.352 0.12 . . . . 0.0 110.797 -179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -53.41 -46.05 36.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.327 2.685 . . . . 0.0 113.234 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.1 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.822 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.644 HD21 ' HG3' ' A' ' 100' ' ' PRO . 14.0 tp -59.82 -43.9 94.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.845 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.721 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 92.7 m -64.62 -37.74 88.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.828 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -63.07 -40.77 98.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.868 0.366 . . . . 0.0 110.896 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.31 -45.61 92.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.429 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.475 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -68.46 -31.27 70.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.424 179.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 23.1 mt -55.7 -52.26 64.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.124 0.488 . . . . 0.0 111.328 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -76.86 -36.69 56.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.986 -177.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.05 -46.65 83.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.734 -178.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.33 90.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.708 0.29 . . . . 0.0 111.58 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -71.31 -26.95 63.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.419 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.6 OUTLIER -92.95 -2.42 55.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.739 178.401 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.9 156.99 17.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.282 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -97.5 101.2 12.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.071 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.496 HG21 HD22 ' A' ' 48' ' ' LEU . 11.4 mm -88.54 115.59 63.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.795 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.31 130.76 35.36 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.537 2.158 . . . . 0.0 112.024 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.415 ' HG2' ' H ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -59.92 121.16 56.34 Favored Pre-proline 0 N--CA 1.445 -0.713 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.891 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.407 ' CB ' ' HB2' ' A' ' 88' ' ' TYR . 47.0 Cg_exo -39.17 104.62 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 124.307 3.338 . . . . 0.0 114.492 -173.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -83.58 -52.2 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.895 2.397 . . . . 0.0 111.843 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.66 126.46 31.04 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -66.47 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.167 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.404 ' O ' HG22 ' A' ' 90' ' ' VAL . . . -66.34 -43.22 86.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 174.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 1.8 t -62.48 -42.54 96.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.606 175.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.407 ' HB2' ' CB ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -60.87 -44.51 96.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.001 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.856 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -70.78 -21.24 62.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -175.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 86' ' ' ALA . 72.4 t -92.53 -55.0 6.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.699 0.285 . . . . 0.0 111.245 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.46 ' HE1' HD11 ' A' ' 96' ' ' LEU . 12.9 m-85 -67.48 -14.95 63.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -173.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.856 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 3.4 pttp -70.31 -6.01 32.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.018 0.437 . . . . 0.0 110.679 177.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -164.93 67.69 0.14 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.103 173.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.448 ' HB3' ' HA ' ' A' ' 91' ' ' PHE . . . -136.24 97.85 11.76 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.866 -176.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.723 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 13.2 Cg_exo -72.02 112.6 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.466 2.111 . . . . 0.0 110.262 178.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.46 HD11 ' HE1' ' A' ' 91' ' ' PHE . 11.8 mt -88.54 149.15 23.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.993 -168.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.61 126.51 34.55 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.585 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.697 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 19.4 t80 -98.54 102.8 14.65 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.1 0.476 . . . . 0.0 109.824 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -109.86 100.09 41.45 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 174.861 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.644 ' HG3' HD21 ' A' ' 66' ' ' LEU . 2.6 Cg_endo . . . . . 0 N--CA 1.461 -0.385 0 C-N-CA 123.334 2.689 . . . . 0.0 113.191 -170.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 95.8 mt . . . . . 0 CA--C 1.531 0.221 0 CA-C-O 120.726 0.298 . . . . 0.0 111.416 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -65.8 -41.73 91.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.167 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -62.5 -46.06 90.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.467 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.414 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -62.06 -48.11 81.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.772 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -63.66 -29.94 71.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.105 0.478 . . . . 0.0 110.862 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.35 -51.84 20.03 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.524 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 3.6 pt20 -66.12 -26.59 67.52 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.703 HG12 HD11 ' A' ' 79' ' ' ILE . 52.5 mt -64.08 -40.54 89.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 20' ' ' ALA . 3.6 mttp -63.93 -42.07 97.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.298 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 m -62.95 -47.18 84.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.942 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.78 -44.59 77.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.282 0.563 . . . . 0.0 110.545 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.2 mt -61.88 -42.0 92.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.378 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.527 ' C ' ' H ' ' A' ' 30' ' ' LYS . 4.0 tm-20 -76.39 -27.7 56.46 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.254 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.3 m -76.9 24.48 0.16 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.561 0.696 . . . . 0.0 110.72 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.527 ' H ' ' C ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -133.34 -33.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.739 177.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.534 0.362 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.59 -176.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.416 HG23 ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -140.37 134.73 31.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.14 92.32 3.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.099 0.476 . . . . 0.0 110.684 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -67.04 118.23 10.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.415 ' HA ' HD22 ' A' ' 44' ' ' LEU . 94.0 mt -108.42 118.46 36.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.767 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.3 mtt180 -82.26 89.57 6.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.784 177.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.31 148.13 6.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.795 -173.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.547 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 11.1 mttt -130.18 103.71 6.89 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.988 176.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.24 145.84 25.14 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.086 0.47 . . . . 0.0 111.701 -174.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.48 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -96.54 160.9 28.46 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.864 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.48 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 27.4 Cg_endo -63.88 0.81 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.035 2.49 . . . . 0.0 113.319 -178.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -104.12 -2.39 25.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.014 0.435 . . . . 0.0 110.555 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.477 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 97.31 -23.66 34.83 Favored Glycine 0 C--O 1.226 -0.354 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.585 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.9 ptm -73.31 148.98 43.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.746 0.308 . . . . 0.0 110.446 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.46 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -85.8 124.79 32.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.808 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.88 -14.7 33.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.167 0.508 . . . . 0.0 109.947 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 42.4 t0 -160.44 140.08 11.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.919 178.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 5.7 tt -159.25 113.32 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 120.971 0.415 . . . . 0.0 110.321 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.46 142.08 25.18 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.725 -178.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.512 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 14.7 Cg_exo -69.72 128.98 16.84 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.456 ' HB3' ' HB ' ' A' ' 43' ' ' THR . 22.8 tt0 -83.19 -57.91 3.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.575 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -156.07 144.46 10.9 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.58 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 158.53 -133.42 3.43 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.384 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -113.52 125.32 29.76 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.84 -43.88 52.74 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.98 2.454 . . . . 0.0 112.82 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.81 -52.01 42.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.126 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.45 ' HA ' HD11 ' A' ' 66' ' ' LEU . 23.1 tp -57.43 -47.3 82.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.968 0.413 . . . . 0.0 110.97 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.608 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.2 m -63.61 -42.71 98.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.06 -178.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.15 -41.01 99.19 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.814 0.34 . . . . 0.0 110.819 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.33 91.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.564 177.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.53 -37.6 81.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.113 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 24.9 mt -59.82 -50.14 74.96 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.587 178.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.13 97.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.168 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.38 81.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.212 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.75 -27.78 69.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.292 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt -69.32 -34.6 74.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.626 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.45 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -85.95 -28.49 24.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -178.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 126.94 31.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.1 mtpt -94.85 107.27 19.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.876 -177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.703 HD11 HG12 ' A' ' 23' ' ' ILE . 6.9 mm -81.42 128.22 70.71 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.062 177.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -64.93 132.35 31.98 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.747 2.298 . . . . 0.0 111.01 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.478 ' HB3' ' HE2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -53.11 128.04 47.54 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.011 -177.094 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.432 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 20.4 Cg_endo -64.49 121.32 8.87 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.782 2.321 . . . . 0.0 112.001 -176.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 6.6 Cg_endo -83.91 -69.06 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.926 2.417 . . . . 0.0 112.53 -176.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.22 134.07 55.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.233 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.405 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 2.1 mt-30 -55.12 -40.42 70.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.726 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.46 -50.97 71.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.951 0.405 . . . . 0.0 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.1 -42.02 95.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.973 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.432 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -65.26 -36.01 82.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.395 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 19.8 mm-40 -76.48 -40.29 50.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.0 110.549 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.2 t -64.33 -46.03 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.177 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -76.99 -6.19 51.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.667 -177.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 8.2 mttt -61.32 -23.72 65.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.023 0.44 . . . . 0.0 110.258 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.462 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.7 OUTLIER -158.11 74.82 0.73 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.968 174.266 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -116.86 81.95 12.63 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.084 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.767 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.7 Cg_exo -73.41 104.83 1.87 Allowed 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.751 2.3 . . . . 0.0 111.192 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.6 146.34 23.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.204 -174.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -79.18 94.15 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.943 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.605 ' HZ ' HG22 ' A' ' 23' ' ' ILE . 1.1 m-85 -86.14 103.2 14.57 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.628 0.727 . . . . 0.0 110.894 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.416 ' HB3' HG23 ' A' ' 41' ' ' THR . 3.3 ptmt -109.92 158.21 35.6 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.46 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_exo . . . . . 0 C--N 1.348 0.536 0 C-N-CA 122.685 2.257 . . . . 0.0 111.582 -179.784 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.6 mm . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.96 0.41 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -44.07 95.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.099 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.427 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 4.5 t-20 -68.45 -32.89 73.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.09 -48.19 45.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.739 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.2 -49.05 78.41 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.162 -179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -61.7 -43.02 99.81 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.344 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -60.87 -32.52 71.95 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.655 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 52.6 mt -67.68 -42.41 86.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.852 0.358 . . . . 0.0 110.362 178.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.81 -40.3 95.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.716 176.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.575 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 12.4 m -64.8 -41.98 95.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.97 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.478 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -56.37 -50.42 71.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.612 HG22 ' HB2' ' A' ' 73' ' ' ALA . 50.5 mt -63.46 -43.85 98.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.5 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.575 ' OE1' ' HA ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -65.61 -26.38 67.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.792 0.33 . . . . 0.0 111.069 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.3 m -76.44 -1.93 29.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.752 0.31 . . . . 0.0 111.093 177.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 6.2 mmtt -115.17 2.14 14.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 0.0 110.636 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.524 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.737 0.303 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.544 HG23 ' HG3' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -122.66 162.14 22.5 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.208 177.633 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.652 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 43.2 t -146.79 142.01 27.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.548 -178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.98 104.27 7.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.517 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.42 125.48 51.03 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.913 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.941 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.4 OUTLIER -74.05 127.81 33.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 173.976 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.482 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.1 pt -129.26 142.3 44.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.073 0.464 . . . . 0.0 110.217 -178.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.47 ' HB2' ' CB ' ' A' ' 56' ' ' ASP . 7.7 mtpt -133.02 115.29 14.98 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.1 mt -79.9 130.2 35.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.129 0.49 . . . . 0.0 111.574 -173.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.466 ' HB3' HD22 ' A' ' 55' ' ' LEU . . . -90.34 158.61 43.25 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.9 176.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -59.75 -13.61 22.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.965 2.444 . . . . 0.0 113.361 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -98.79 -6.41 29.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.374 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.444 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 110.88 -19.8 25.08 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.29 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.36 158.66 27.39 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.921 0.36 . . . . 0.0 111.059 -178.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -88.98 106.94 18.75 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 175.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.466 HD22 ' HB3' ' A' ' 49' ' ' ALA . 1.3 pp -72.82 -31.88 65.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.304 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.482 ' O ' ' HA ' ' A' ' 46' ' ' ILE . 0.4 OUTLIER -118.74 124.8 48.17 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.718 176.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.1 tp -148.56 106.72 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.246 0.546 . . . . 0.0 109.648 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -147.86 128.45 6.89 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.96 -172.787 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.652 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 12.6 Cg_exo -70.26 92.7 0.56 Allowed 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.098 2.532 . . . . 0.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.33 -45.8 75.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.484 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -141.82 -179.12 18.61 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.504 -0.638 . . . . 0.0 111.504 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.652 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 102.32 -178.15 26.45 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.64 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.95 121.92 83.3 Favored Pre-proline 0 C--N 1.327 -0.399 0 C-N-CA 122.415 0.286 . . . . 0.0 110.49 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.82 -43.48 54.15 Favored 'Trans proline' 0 CA--C 1.528 0.216 0 C-N-CA 122.79 2.327 . . . . 0.0 112.74 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.19 -38.95 92.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.853 0.359 . . . . 0.0 111.17 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.415 HD23 ' HD3' ' A' ' 100' ' ' PRO . 37.1 tp -71.49 -45.98 61.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 178.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.652 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 68.8 m -65.92 -38.99 90.15 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.703 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -64.55 -37.23 86.82 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.819 0.342 . . . . 0.0 110.455 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.07 -37.22 72.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.384 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.99 -27.91 69.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.004 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.496 ' HA ' HD23 ' A' ' 71' ' ' LEU . 25.5 mt -61.1 -45.31 95.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 110.365 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.25 86.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.621 178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.612 ' HB2' HG22 ' A' ' 27' ' ' ILE . . . -64.45 -44.14 92.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.341 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.99 70.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -74.83 -25.98 59.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.339 177.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.0 -13.43 50.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.316 0.579 . . . . 0.0 110.296 177.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -86.28 149.23 25.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.096 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -125.86 91.37 3.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.851 0.357 . . . . 0.0 110.075 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.54 HG21 ' HD2' ' A' ' 80' ' ' PRO . 29.2 mm -66.24 127.84 93.49 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.656 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.54 ' HD2' HG21 ' A' ' 79' ' ' ILE . 30.9 Cg_endo -67.48 153.64 76.0 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.57 2.18 . . . . 0.0 112.263 -175.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.23 122.14 73.7 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.925 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.402 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 50.3 Cg_exo -41.34 118.45 0.77 Allowed 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 123.835 3.023 . . . . 0.0 113.879 -174.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 3.1 Cg_endo -79.38 -75.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 123.109 2.539 . . . . 0.0 111.38 177.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.8 124.98 27.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.895 175.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -64.01 -26.97 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.58 0.229 . . . . 0.0 111.021 -177.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.02 -25.9 68.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.204 0.526 . . . . 0.0 110.969 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -30.65 16.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.795 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -78.6 -38.0 41.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.271 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.43 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 25.7 pt-20 -67.76 -18.67 64.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.87 0.367 . . . . 0.0 110.877 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -92.07 -49.54 13.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.681 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -87.81 26.24 1.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -177.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.43 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.1 ttmt -73.08 -31.07 64.13 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.082 0.468 . . . . 0.0 110.27 177.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.448 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 12.5 p-10 -151.87 38.47 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.106 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -102.85 103.63 34.46 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 177.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.941 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.9 Cg_exo -72.25 155.11 56.53 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.886 2.391 . . . . 0.0 112.037 -174.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -99.19 132.44 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.294 -172.665 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -92.19 120.07 32.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.98 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -117.02 142.49 46.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.382 0.611 . . . . 0.0 111.723 -172.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.544 ' HG3' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -145.18 143.56 20.79 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.532 174.226 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.415 ' HD3' HD23 ' A' ' 66' ' ' LEU . 60.6 Cg_exo . . . . . 0 C--N 1.344 0.338 0 C-N-CA 122.665 2.243 . . . . 0.0 111.737 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.446 ' HA ' HG21 ' A' ' 87' ' ' VAL . 1.7 mt . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.134 0.492 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -66.17 -32.02 73.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.681 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -62.17 -43.84 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 177.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 23' ' ' ILE . 11.3 t80 -62.54 -48.36 79.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 177.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.63 -45.64 85.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 111.293 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.36 -35.9 90.87 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.489 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -66.97 -38.96 87.03 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.465 0.172 . . . . 0.0 111.465 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.618 HG12 HG21 ' A' ' 79' ' ' ILE . 14.1 mt -63.17 -43.14 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.436 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -62.81 -40.19 96.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.722 177.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.2 m -70.26 -34.24 72.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.924 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.09 -40.57 94.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.007 0.432 . . . . 0.0 110.752 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.592 HG23 ' HB2' ' A' ' 73' ' ' ALA . 37.7 mt -66.18 -37.91 80.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.641 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.98 -20.79 60.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.905 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -74.24 -7.94 54.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.215 0.531 . . . . 0.0 110.7 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.614 ' HD2' ' HB2' ' A' ' 76' ' ' LEU . 2.5 mmtm -114.21 -27.16 7.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.034 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.41 174.756 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.774 0.321 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.87 153.12 50.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.103 176.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 117.32 12.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.879 0.371 . . . . 0.0 110.959 -178.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 m -84.9 104.8 15.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.789 0.328 . . . . 0.0 110.465 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.0 mt -93.49 114.0 26.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.239 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.617 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.6 ttm180 -74.52 96.16 2.89 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.2 pt -117.59 113.78 43.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.382 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.687 ' HG2' HD21 ' A' ' 55' ' ' LEU . 3.2 tttt -97.91 111.72 23.92 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.511 HD12 ' HD2' ' A' ' 91' ' ' PHE . 2.2 mt -94.8 124.86 39.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.0 0.428 . . . . 0.0 110.888 -174.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.61 152.92 95.23 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.011 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.08 -20.17 44.57 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.177 2.584 . . . . 0.0 113.472 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -83.82 -4.03 58.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.699 0.285 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.81 44.45 4.83 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.608 176.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.433 ' O ' ' HG3' ' A' ' 53' ' ' MET . 0.0 OUTLIER -139.39 142.39 37.53 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 177.221 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.83 96.83 7.12 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.777 0.322 . . . . 0.0 110.151 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.687 HD21 ' HG2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -73.01 -35.17 66.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.023 0.44 . . . . 0.0 110.14 -178.71 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.43 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 34.3 t0 -126.62 101.84 6.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.217 177.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 tt -127.99 111.36 24.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.06 0.457 . . . . 0.0 110.294 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -153.79 141.8 13.94 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 -177.821 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 20.6 Cg_exo -64.8 124.68 13.52 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.459 2.106 . . . . 0.0 111.865 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.15 -54.57 4.93 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -162.07 144.61 9.87 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 177.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 157.32 -130.03 2.53 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.501 -178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.6 121.59 25.79 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.551 0.215 . . . . 0.0 110.56 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -46.72 -45.0 20.98 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 123.596 2.864 . . . . 0.0 113.431 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.59 -52.11 65.75 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.716 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.452 ' HG ' ' CE2' ' A' ' 98' ' ' PHE . 9.2 tp -66.22 -42.64 88.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 4.0 m -63.51 -42.19 98.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.595 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -65.87 -39.8 91.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.07 91.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.291 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 74' ' ' ALA . . . -67.32 -46.31 73.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.723 176.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 71' ' ' LEU . 1.4 mt -55.06 -46.09 75.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.012 0.434 . . . . 0.0 111.026 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.85 88.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.728 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.592 ' HB2' HG23 ' A' ' 27' ' ' ILE . . . -81.98 -41.57 20.58 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -176.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 70' ' ' ALA . . . -60.67 -32.96 72.14 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.63 61.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.169 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.614 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 1.9 mt -90.62 -25.43 20.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 110.566 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.44 138.64 58.52 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.636 -174.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 81.1 2.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.331 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.618 HG21 HG12 ' A' ' 23' ' ' ILE . 2.3 mp -71.44 126.17 91.76 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.552 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.7 Cg_exo -66.8 177.66 3.34 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 123.08 2.52 . . . . 0.0 112.007 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 142.92 31.09 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.271 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.416 ' HG3' ' CZ ' ' A' ' 91' ' ' PHE . 6.5 Cg_endo -48.68 118.27 3.28 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.401 2.734 . . . . 0.0 112.223 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.57 -29.01 70.12 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.089 2.526 . . . . 0.0 113.313 -175.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.22 159.48 40.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.853 0.358 . . . . 0.0 111.278 -177.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -62.76 -34.75 77.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.12 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.19 -37.9 81.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.446 HG21 ' HA ' ' A' ' 16' ' ' ILE . 2.2 t -74.63 -26.87 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.866 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.479 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.3 OUTLIER -61.59 -37.94 85.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.498 178.23 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -72.44 -35.33 68.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.556 ' O ' ' HB1' ' A' ' 94' ' ' ALA . 84.2 t -70.38 -54.54 18.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.579 -177.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.511 ' HD2' HD12 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -71.01 9.23 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -174.628 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.479 ' HD2' ' O ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -75.04 -25.4 58.68 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.111 -0.368 . . . . 0.0 111.227 177.444 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -173.74 34.64 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.667 0.27 . . . . 0.0 111.628 -177.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.556 ' HB1' ' O ' ' A' ' 90' ' ' VAL . . . -102.54 113.05 66.08 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 120.823 0.344 . . . . 0.0 110.691 176.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.617 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 20.1 Cg_exo -72.83 144.72 39.41 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.052 2.501 . . . . 0.0 111.542 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.506 ' HA ' HD22 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -91.69 142.87 27.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -174.869 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.83 97.19 9.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.454 173.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.452 ' CE2' ' HG ' ' A' ' 66' ' ' LEU . 57.6 t80 -79.3 107.4 12.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.454 0.645 . . . . 0.0 110.596 -177.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.587 ' HG2' ' HD2' ' A' ' 100' ' ' PRO . 5.3 ttpt -150.03 148.89 26.09 Favored Pre-proline 0 C--N 1.311 -1.086 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.587 ' HD2' ' HG2' ' A' ' 99' ' ' LYS . 23.8 Cg_exo . . . . . 0 C--N 1.353 0.774 0 C-N-CA 124.202 3.268 . . . . 0.0 112.564 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.0 mt . . . . . 0 N--CA 1.457 -0.078 0 CA-C-O 120.959 0.409 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -60.48 -33.21 72.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.862 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 17.4 t-20 -74.69 -47.77 29.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.687 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -68.27 -37.73 81.01 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.205 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.94 -27.19 64.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.432 0.634 . . . . 0.0 109.459 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.73 -27.86 73.57 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.052 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 18' ' ' ASN . 50.8 mm-40 -63.4 -33.31 75.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.049 0.452 . . . . 0.0 109.966 176.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.8 mm -77.26 -42.27 30.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.656 176.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.454 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 4.7 mtpm? -58.88 -53.85 53.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.338 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -59.75 -33.08 71.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.657 0.265 . . . . 0.0 111.292 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.3 -50.13 71.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.498 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 74.7 mt -68.3 -32.62 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.206 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -20.66 66.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.951 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.44 14.86 28.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 177.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.423 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -148.89 33.3 0.76 Allowed 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.14 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.3 p90 . . . . . 0 N--CA 1.433 -1.307 0 CA-C-N 113.756 -1.566 . . . . 0.0 112.676 -167.993 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.526 ' O ' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.228 -0.078 0 CA-C-O 120.537 0.208 . . . . 0.0 110.572 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.42 ' HA ' ' HB3' ' A' ' 99' ' ' LYS . 23.7 m -153.95 115.83 4.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.535 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.5 OUTLIER -121.16 177.97 4.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.147 -178.571 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.8 m -148.89 122.24 9.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.202 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.8 mt -94.23 113.55 25.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.569 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.69 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 tmm_? -78.15 89.44 4.25 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 175.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -102.37 136.67 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.051 -173.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.574 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -114.63 100.15 8.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.319 177.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 tp -86.34 126.41 34.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.202 -174.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -76.92 167.74 34.12 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.246 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.539 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 6.7 Cg_endo -52.66 -37.96 75.71 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.162 2.575 . . . . 0.0 113.657 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -74.01 -10.7 59.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.948 0.404 . . . . 0.0 111.406 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 97.73 11.58 50.03 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.032 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ptm -98.94 146.71 25.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.422 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -77.48 109.59 11.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.77 0.319 . . . . 0.0 110.306 -179.09 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.61 -21.23 30.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.374 0.607 . . . . 0.0 109.893 178.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.574 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 48.1 t0 -149.3 135.55 19.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.106 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.7 tt -153.89 113.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.221 0.534 . . . . 0.0 110.372 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.6 tttp -151.85 132.61 7.54 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.084 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.535 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 50.8 Cg_exo -55.44 125.41 19.05 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.713 2.275 . . . . 0.0 112.214 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -77.31 -53.53 7.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.965 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -174.39 151.76 13.3 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.038 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.535 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 149.88 -101.67 0.22 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.808 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.555 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 12.6 t70 -141.42 129.44 12.06 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 -178.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -56.33 -40.65 83.3 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.362 2.708 . . . . 0.0 113.432 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.07 -38.3 63.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.928 0.394 . . . . 0.0 110.984 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -66.58 -50.21 63.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.551 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.647 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.3 m -69.45 -21.91 63.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.509 -177.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -67.74 -50.55 56.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.15 -31.47 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.377 177.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 98' ' ' PHE . . . -56.44 -46.19 80.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.45 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 6.4 mt -62.69 -41.31 99.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.893 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.04 -44.89 79.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.018 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.498 ' HB3' ' CG2' ' A' ' 27' ' ' ILE . . . -64.91 -43.01 94.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.03 -24.56 66.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 0.0 110.952 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 -28.49 46.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.565 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.423 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -86.99 -20.14 27.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.884 -178.074 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -92.59 149.75 21.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.498 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 pttp -105.73 135.41 47.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.422 0.63 . . . . 0.0 111.051 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.5 mp -110.09 130.84 22.4 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.288 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -84.67 164.47 12.2 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.143 1.895 . . . . 0.0 112.21 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 ttmm -70.88 126.87 92.19 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.933 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.456 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 52.4 Cg_exo -54.66 117.73 4.31 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.947 2.432 . . . . 0.0 112.048 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -70.31 -62.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.571 2.181 . . . . 0.0 112.832 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.65 138.81 32.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.748 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.514 ' HA ' ' HB3' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -61.05 -30.79 70.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 0.0 111.046 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.09 -52.76 63.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 177.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -69.12 -35.51 68.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.046 0.45 . . . . 0.0 110.404 178.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.514 ' HB3' ' HA ' ' A' ' 85' ' ' GLN . 0.9 OUTLIER -56.39 -43.87 79.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.873 179.682 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 33.7 mt-10 -75.61 -35.01 60.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.171 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.3 t -64.98 -43.16 96.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.106 0.479 . . . . 0.0 109.885 178.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -83.69 41.83 0.81 Allowed 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.077 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 1.1 tpmp? -101.82 -23.98 14.11 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.121 0.486 . . . . 0.0 109.738 175.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -158.98 59.89 0.42 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.052 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.12 95.78 49.16 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.595 -176.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.69 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.1 Cg_exo -72.96 137.72 27.18 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 123.012 2.474 . . . . 0.0 111.511 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.38 153.66 17.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.77 133.49 40.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.191 173.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 70' ' ' ALA . 0.7 OUTLIER -131.82 103.06 6.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.519 0.676 . . . . 0.0 111.25 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.623 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.3 OUTLIER -139.95 167.6 17.78 Favored Pre-proline 0 C--N 1.315 -0.912 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.389 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.623 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 9.5 Cg_endo . . . . . 0 C--N 1.353 0.803 0 C-N-CA 123.059 2.506 . . . . 0.0 110.626 175.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.753 ' HA ' HG21 ' A' ' 87' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.968 0.413 . . . . 0.0 110.835 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -60.5 -26.73 67.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.864 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.32 -52.53 53.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.654 0.264 . . . . 0.0 110.56 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.583 178.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.532 ' HA ' HD11 ' A' ' 23' ' ' ILE . . . -64.28 -39.85 94.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.233 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.52 -33.46 87.31 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.733 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.89 -38.77 86.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.587 0.232 . . . . 0.0 111.214 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.532 HD11 ' HA ' ' A' ' 20' ' ' ALA . 5.8 mt -62.51 -36.03 72.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.003 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 20' ' ' ALA . 3.6 mmtp -58.46 -50.18 74.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.147 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.51 -32.74 58.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.539 -178.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.89 -47.94 83.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.14 0.495 . . . . 0.0 111.212 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.469 HD13 HG23 ' A' ' 23' ' ' ILE . 84.1 mt -73.92 -31.39 30.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.804 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -29.38 70.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.912 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.97 -8.54 59.0 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.987 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.49 36.34 4.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.79 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.0 p90 . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 121.482 0.658 . . . . 0.0 110.956 -178.984 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mmtp . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.849 0.357 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.39 162.37 22.9 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.205 175.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.71 107.1 1.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.695 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.2 m -87.59 135.01 33.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.786 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 70' ' ' ALA . 0.1 OUTLIER -127.0 126.73 43.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.82 0.343 . . . . 0.0 110.692 -179.033 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.802 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 2.7 ttm-85 -80.61 97.92 7.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.715 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.6 pt -105.91 149.07 9.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.33 0.586 . . . . 0.0 111.528 -175.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.558 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 22.1 mttp -127.1 109.4 11.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.932 177.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -95.39 150.14 20.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.395 0.617 . . . . 0.0 111.694 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -111.58 161.06 27.14 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.366 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.05 -17.07 43.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.23 2.62 . . . . 0.0 113.169 -178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.9 0.43 51.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.791 0.329 . . . . 0.0 111.125 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.62 29.54 52.02 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.869 177.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -132.88 143.98 49.87 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.494 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -89.49 112.48 23.66 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.846 0.355 . . . . 0.0 110.352 -178.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -30.87 62.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.224 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.558 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.8 t70 -133.32 139.52 46.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.176 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.487 HG12 HD21 ' A' ' 71' ' ' LEU . 5.6 tt -155.78 106.78 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.293 0.568 . . . . 0.0 109.652 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.03 133.75 24.89 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.133 -172.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -60.47 125.52 17.59 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.461 2.107 . . . . 0.0 111.613 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' ' 45' ' ' ARG . 9.4 mm-40 -87.66 -68.57 0.75 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.703 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.75 133.74 4.31 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.272 -0.877 . . . . 0.0 111.291 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 154.45 -159.16 28.71 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.176 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -78.18 125.87 84.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.469 0.176 . . . . 0.0 110.76 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 53.3 Cg_exo -53.6 -37.32 83.09 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.923 2.415 . . . . 0.0 112.82 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.09 -43.58 42.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.213 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -65.99 -47.09 75.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.884 0.373 . . . . 0.0 110.388 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.572 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.3 m -62.58 -44.63 95.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.506 ' HA ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -61.16 -41.51 96.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.907 178.401 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.53 -31.56 72.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.022 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.469 ' HB3' HD12 ' A' ' 44' ' ' LEU . . . -69.83 -44.93 68.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 0.1 OUTLIER -62.31 -41.92 98.94 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.836 0.35 . . . . 0.0 110.576 178.696 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -46.57 87.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.957 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.15 -43.43 91.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.545 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.36 75.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.36 -26.08 55.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.712 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.05 -33.14 33.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.409 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.93 166.95 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.028 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.22 115.39 26.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.1 178.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.487 HD11 HG22 ' A' ' 23' ' ' ILE . 28.5 mm -87.31 125.63 65.14 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.959 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.55 124.86 17.28 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.414 2.076 . . . . 0.0 111.715 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.44 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -55.86 145.48 52.57 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.665 -178.386 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.458 ' HG3' ' HZ ' ' A' ' 91' ' ' PHE . 12.4 Cg_exo -34.64 99.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 125.129 3.886 . . . . 0.0 114.774 -175.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -79.07 -37.52 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.529 2.153 . . . . 0.0 111.251 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -99.42 146.69 26.05 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.012 177.235 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -76.83 -40.08 49.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 111.074 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.9 -27.59 64.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.924 0.393 . . . . 0.0 111.249 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.753 HG21 ' HA ' ' A' ' 16' ' ' ILE . 0.5 OUTLIER -71.0 -23.7 23.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.618 -178.208 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.51 ' HA ' ' CZ ' ' A' ' 91' ' ' PHE . 89.6 t80 -65.4 -34.03 77.35 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.103 0.477 . . . . 0.0 110.467 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.53 -18.35 60.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.563 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 52.5 t -85.93 -53.4 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.938 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.51 ' CZ ' ' HA ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -81.25 9.87 6.36 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -173.182 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -61.61 -30.18 70.52 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.557 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 10.8 t30 -160.09 72.53 0.5 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.529 -1.214 . . . . 0.0 108.643 171.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 90' ' ' VAL . . . -113.17 84.58 7.38 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.943 -175.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.802 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 21.2 Cg_exo -73.46 110.78 3.14 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.065 2.51 . . . . 0.0 111.71 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.63 151.7 19.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.823 -175.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.695 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 29.2 t70 -103.76 100.94 10.77 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 176.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.53 135.06 33.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.227 0.536 . . . . 0.0 111.251 -176.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.26 144.01 49.17 Favored Pre-proline 0 C--N 1.323 -0.584 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.701 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_exo . . . . . 0 N--CA 1.475 0.419 0 C-N-CA 124.061 3.174 . . . . 0.0 112.061 -179.791 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.554 HG23 ' HA ' ' A' ' 87' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.711 0.291 . . . . 0.0 111.234 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -36.91 85.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.076 0.465 . . . . 0.0 110.554 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -69.91 -37.96 76.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.336 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -42.61 99.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.672 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' A' ' 23' ' ' ILE . . . -66.64 -36.42 82.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 0.0 111.111 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.26 -33.79 56.04 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.815 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -28.29 69.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.693 0.283 . . . . 0.0 111.432 -176.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.469 ' O ' HG13 ' A' ' 27' ' ' ILE . 4.0 mt -70.76 -35.5 60.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.71 0.291 . . . . 0.0 110.485 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -59.87 -47.62 85.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.74 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -35.54 75.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.886 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -47.71 81.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.397 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.581 HG22 ' HB1' ' A' ' 73' ' ' ALA . 53.6 mt -64.59 -36.72 78.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.943 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -64.2 -38.57 91.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 110.962 176.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.1 m -73.15 -10.42 59.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.164 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.706 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.23 -8.79 15.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.2 -178.608 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.449 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.361 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 176.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 120.856 0.36 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -127.3 128.35 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.642 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.21 105.25 6.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.093 0.473 . . . . 0.0 111.473 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -89.27 118.25 28.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.435 -179.362 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.61 127.37 54.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.36 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.818 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 1.1 tpp180 -80.1 111.89 16.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.9 pt -120.97 137.58 54.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.285 0.564 . . . . 0.0 110.771 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -122.93 111.07 16.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.354 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.6 tp -94.95 143.67 26.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.17 0.51 . . . . 0.0 111.701 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -103.39 166.67 11.37 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.542 177.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -64.17 -11.51 28.04 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.168 1.912 . . . . 0.0 111.782 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.449 ' O ' ' HG3' ' A' ' 81' ' ' LYS . 24.5 t70 -85.52 -13.38 49.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.309 176.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.03 -15.39 63.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.349 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.53 149.16 36.73 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.975 0.417 . . . . 0.0 110.607 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.26 105.55 17.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.887 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.25 -30.63 69.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.561 . . . . 0.0 109.85 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -135.24 131.45 36.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.65 176.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -156.49 105.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.172 0.511 . . . . 0.0 109.656 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.424 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 7.0 ptpp? -154.77 148.18 18.48 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.906 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.648 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 10.4 Cg_exo -73.0 129.61 14.44 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.032 2.488 . . . . 0.0 111.663 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.36 -70.56 0.72 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.9 127.34 6.96 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.674 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 164.45 -138.8 5.47 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.592 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.521 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 11.5 t70 -122.78 129.97 24.81 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 53.6 Cg_exo -55.76 -34.4 90.85 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.131 2.554 . . . . 0.0 113.68 -176.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.77 -43.3 18.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.751 0.31 . . . . 0.0 110.76 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -58.82 -52.25 66.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.569 178.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 11.9 m -63.06 -36.76 84.65 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.846 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -63.53 -43.24 97.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.72 0.295 . . . . 0.0 110.787 177.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.12 99.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.069 0.461 . . . . 0.0 110.221 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.86 95.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.048 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 66.9 mt -57.56 -49.55 76.02 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.835 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.45 -41.62 94.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.168 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.581 ' HB1' HG22 ' A' ' 27' ' ' ILE . . . -71.64 -40.62 69.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.263 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.03 75.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.842 0.353 . . . . 0.0 111.142 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -68.21 -23.85 64.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.176 0.512 . . . . 0.0 110.891 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.706 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -103.54 3.32 34.59 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.57 179.468 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.45 146.28 45.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.182 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.79 86.25 7.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.87 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.3 109.02 62.73 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.926 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -72.1 159.88 48.83 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.983 2.455 . . . . 0.0 112.762 -174.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 51' ' ' ASP . 2.3 ttmt -69.75 117.55 54.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.499 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 81' ' ' LYS . 32.6 Cg_exo -65.48 109.76 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.764 2.31 . . . . 0.0 112.81 -175.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 81' ' ' LYS . 58.4 Cg_endo -82.72 -40.44 0.12 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.468 2.112 . . . . 0.0 111.852 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.3 120.37 20.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.309 177.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -65.12 -31.9 73.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.924 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 90' ' ' VAL . . . -61.18 -36.43 79.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.006 0.432 . . . . 0.0 110.643 176.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.554 ' HA ' HG23 ' A' ' 16' ' ' ILE . 28.6 t -68.48 -48.98 69.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.544 177.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -37.65 83.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 -179.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.9 mm-40 -71.67 -33.08 68.54 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.622 -178.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 86' ' ' ALA . 42.8 t -75.25 -38.0 40.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.193 0.52 . . . . 0.0 110.132 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -79.47 13.7 1.89 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.596 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -70.43 -22.84 62.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.172 175.744 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -161.58 77.84 0.54 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.154 174.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -129.83 80.84 70.6 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.264 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.818 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.4 Cg_exo -73.18 141.24 32.15 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.747 2.298 . . . . 0.0 111.742 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.3 mt -97.96 129.43 44.86 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.291 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.492 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 31.8 t70 -97.85 95.21 7.37 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 172.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -104.32 139.49 39.23 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.492 0.663 . . . . 0.0 112.14 -169.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.38 150.1 48.92 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 114.466 -1.243 . . . . 0.0 107.808 171.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.405 ' HD3' HD13 ' A' ' 66' ' ' LEU . 14.5 Cg_endo . . . . . 0 C--N 1.344 0.294 0 C-N-CA 121.915 1.743 . . . . 0.0 110.817 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.767 ' HA ' HG21 ' A' ' 87' ' ' VAL . 6.9 mt . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.843 0.354 . . . . 0.0 110.972 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.88 -37.49 84.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.664 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -70.23 -47.23 62.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.751 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -58.44 -49.04 78.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.992 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.28 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.259 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.81 -49.1 10.84 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.179 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -56.81 -39.28 73.89 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 122.72 0.408 . . . . 0.0 111.658 -177.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.467 HG21 HD11 ' A' ' 96' ' ' LEU . 76.0 mt -57.72 -43.8 84.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.995 0.426 . . . . 0.0 110.61 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HA ' ' HZ ' ' A' ' 98' ' ' PHE . 31.8 mttp -65.09 -47.77 76.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.927 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.47 -39.35 79.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.392 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.53 -46.63 75.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.047 0.451 . . . . 0.0 110.677 178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.7 mt -62.96 -50.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.287 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -20.82 66.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.037 -176.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 60.1 m -67.45 -11.84 58.84 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.77 0.319 . . . . 0.0 111.049 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.423 ' HE2' ' HA ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -113.17 9.81 18.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.091 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.406 ' HZ ' ' HA ' ' A' ' 70' ' ' ALA . 1.9 m-30 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.479 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 120.989 0.423 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.28 168.7 11.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.602 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 4.7 t -152.89 57.64 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.049 0.452 . . . . 0.0 110.522 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 m -69.36 114.13 7.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.809 0.338 . . . . 0.0 110.219 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.33 124.28 49.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.805 -176.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.557 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -77.63 97.32 5.06 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 174.567 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.503 HD12 HD12 ' A' ' 96' ' ' LEU . 1.1 pt -121.41 145.54 27.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -174.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -127.94 115.34 18.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.384 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.9 mt -94.54 125.02 38.92 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.741 -175.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.453 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -75.26 148.1 83.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.392 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.652 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 2.4 Cg_endo -48.87 -28.4 13.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.899 3.066 . . . . 0.0 113.621 -176.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.46 7.49 9.71 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.32 46.65 9.86 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.378 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.453 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.51 139.12 26.57 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.165 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.63 122.57 24.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.857 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.2 pp -93.81 -31.16 14.48 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -129.48 138.44 51.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.634 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.425 HG12 HD22 ' A' ' 71' ' ' LEU . 3.2 tt -159.15 106.9 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.232 0.539 . . . . 0.0 110.101 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -145.43 139.98 15.47 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.904 -175.331 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 14.9 Cg_exo -66.23 120.67 7.84 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.604 2.203 . . . . 0.0 111.196 176.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -102.53 -49.52 3.83 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.421 -175.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -145.9 111.2 0.57 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.278 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 160.3 -161.95 32.92 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.117 -1.04 . . . . 0.0 112.587 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 14.8 t70 -78.75 129.85 72.48 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 120.752 0.311 . . . . 0.0 110.689 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.456 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 31.2 Cg_exo -62.25 -34.03 79.34 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.071 2.514 . . . . 0.0 112.929 -176.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -79.62 -41.76 26.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.92 0.391 . . . . 0.0 110.627 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.413 ' CB ' ' HB3' ' A' ' 63' ' ' ASP . 31.2 tp -59.21 -52.88 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.687 178.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 60.3 m -73.22 -15.13 61.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.716 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -72.68 -39.07 67.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.179 0.514 . . . . 0.0 109.873 174.283 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.86 62.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.379 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.406 ' HA ' ' HZ ' ' A' ' 31' ' ' PHE . . . -60.84 -38.01 84.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.198 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 3.0 mt -61.92 -41.41 97.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.139 0.495 . . . . 0.0 110.278 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.71 71.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.809 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.97 91.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.47 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.66 -30.45 71.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.869 0.366 . . . . 0.0 111.343 -178.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -32.79 58.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.352 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -31.69 36.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.681 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.423 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . . . -70.74 157.61 37.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.981 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.29 94.14 4.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.605 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.417 HD12 HG12 ' A' ' 23' ' ' ILE . 33.1 mm -76.33 122.09 86.11 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.803 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.7 153.79 76.62 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.681 2.254 . . . . 0.0 111.675 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.605 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 0.9 OUTLIER -74.53 147.0 84.43 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 175.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.605 ' HD2' ' HG2' ' A' ' 81' ' ' LYS . 10.6 Cg_endo -52.96 117.03 3.32 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.928 2.419 . . . . 0.0 111.955 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -78.67 -64.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.236 1.958 . . . . 0.0 112.404 -177.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 48.2 m -95.49 159.94 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.153 0.501 . . . . 0.0 111.133 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.9 -27.91 68.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.667 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.35 -50.78 71.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.575 -177.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.767 HG21 ' HA ' ' A' ' 16' ' ' ILE . 4.1 p -74.76 -22.66 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.288 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -62.04 -35.95 80.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.289 0.566 . . . . 0.0 110.657 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.612 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.65 -18.0 55.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.138 -178.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.06 -53.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.927 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.652 ' HZ ' ' HA ' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -61.82 -19.03 62.11 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -171.184 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.612 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 8.8 ptpt -73.22 -6.54 46.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.59 -178.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -162.19 50.92 0.2 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.967 0.413 . . . . 0.0 111.15 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -132.84 105.49 12.74 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.228 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.557 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 3.0 Cg_exo -73.77 139.9 28.41 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.707 2.271 . . . . 0.0 110.923 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.503 HD12 HD12 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -89.56 127.53 35.89 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.066 0.46 . . . . 0.0 111.366 -175.053 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -93.07 94.35 8.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 173.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.527 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 0.3 OUTLIER -88.18 137.75 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.652 -171.658 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -137.73 112.51 9.06 Favored Pre-proline 0 C--N 1.319 -0.752 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.8 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo . . . . . 0 C--O 1.235 0.333 0 C-N-CA 123.608 2.872 . . . . 0.0 113.752 -173.181 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.523 HG12 HG23 ' A' ' 87' ' ' VAL . 22.9 mt . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 120.908 0.385 . . . . 0.0 110.688 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -59.41 -45.08 92.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.778 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -67.38 -48.57 67.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.938 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.536 ' HD2' ' HG2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -60.52 -34.78 74.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.624 -176.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.54 96.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.961 0.41 . . . . 0.0 110.995 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.34 -29.22 62.43 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.891 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -62.67 -37.22 85.55 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 122.148 0.179 . . . . 0.0 111.008 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 12.8 mt -58.39 -44.8 89.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.022 0.439 . . . . 0.0 110.717 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -64.3 -45.42 88.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.084 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -72.45 -31.12 65.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.428 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.39 -45.95 83.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.038 0.447 . . . . 0.0 111.081 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.461 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 57.9 mt -60.84 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.123 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -74.25 -21.29 59.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.563 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.8 m -67.53 -17.23 64.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.055 0.455 . . . . 0.0 109.816 175.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.7 -47.97 4.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.496 172.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.512 -179.842 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.29 0 CA-C-O 121.19 0.519 . . . . 0.0 111.684 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.3 152.07 36.47 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.829 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.478 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -163.56 90.33 0.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.156 0.503 . . . . 0.0 110.937 -179.601 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.745 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -70.87 116.88 11.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.409 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.2 mt -99.06 118.13 35.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.7 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.2 ttt180 -80.53 101.14 8.95 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.405 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -120.26 137.24 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.36 0.6 . . . . 0.0 111.588 -175.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.604 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -129.8 109.23 10.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.107 -0.952 . . . . 0.0 108.605 174.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.51 144.07 36.65 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.529 0.681 . . . . 0.0 111.627 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -100.48 161.5 23.8 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.577 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.651 ' HG3' ' HB2' ' A' ' 88' ' ' TYR . 36.4 Cg_exo -57.45 -14.19 15.62 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.041 2.494 . . . . 0.0 112.699 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.22 -11.89 59.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.107 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.2 34.64 23.06 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.886 -179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.47 144.44 47.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.787 0.327 . . . . 0.0 110.238 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.464 HD11 HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -100.09 97.21 8.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.8 178.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -29.8 63.62 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.438 -177.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.604 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -129.07 127.09 40.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.319 176.793 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.635 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.0 OUTLIER -159.08 108.77 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.339 -175.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -158.0 151.38 18.95 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -72.45 119.81 6.35 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.926 2.417 . . . . 0.0 111.963 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.745 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 74.3 mt-10 -82.37 -65.06 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.143 0.496 . . . . 0.0 109.766 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -143.77 123.6 2.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.384 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.478 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 173.84 -178.02 45.89 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.375 -0.917 . . . . 0.0 112.795 -178.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.34 129.63 90.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.37 -47.82 25.3 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.939 2.426 . . . . 0.0 112.649 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.26 -46.88 75.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.192 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.558 HD22 ' HG3' ' A' ' 100' ' ' PRO . 29.6 tp -58.96 -55.31 36.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.122 -179.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.648 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.8 m -63.3 -31.74 72.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.045 -177.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -63.83 -46.34 85.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.77 0.319 . . . . 0.0 110.592 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.19 -34.2 74.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.534 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.3 78.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.227 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 51.8 mt -59.96 -44.43 94.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.101 0.477 . . . . 0.0 110.56 178.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.75 73.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.827 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.461 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -64.11 -45.34 89.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.75 -178.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.14 -35.34 80.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.906 0.384 . . . . 0.0 111.155 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -68.57 -32.84 73.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.545 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.3 mp -80.48 -32.04 37.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.856 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.11 130.37 43.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.659 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -88.38 84.68 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.503 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mt -70.84 132.18 87.07 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.602 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.536 ' HG2' ' HD2' ' A' ' 19' ' ' TYR . 18.9 Cg_endo -61.83 125.26 16.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.747 2.298 . . . . 0.0 112.083 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.442 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -75.33 132.39 76.19 Favored Pre-proline 0 N--CA 1.443 -0.798 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.417 -178.832 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -52.92 115.71 2.44 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.959 2.44 . . . . 0.0 112.712 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -81.14 -69.51 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.95 2.434 . . . . 0.0 111.214 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.67 146.65 49.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.596 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.23 -26.76 68.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.855 0.36 . . . . 0.0 111.446 -175.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.07 -27.44 69.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.108 178.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.523 HG23 HG12 ' A' ' 16' ' ' ILE . 13.6 t -77.26 -32.2 18.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.651 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -61.92 -35.5 78.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.06 0.457 . . . . 0.0 110.225 178.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.525 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -67.74 -27.17 66.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.171 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 87' ' ' VAL . 40.3 t -68.24 -57.32 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.214 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.431 ' HD1' ' HA ' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -85.5 3.35 40.79 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -176.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.525 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -63.82 -23.94 67.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.915 0.388 . . . . 0.0 110.411 178.469 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -163.62 78.22 0.41 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.749 174.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -135.47 84.25 34.96 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.144 -177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.7 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 4.3 Cg_exo -74.4 104.68 1.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.786 2.324 . . . . 0.0 110.629 177.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.82 140.67 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.21 -174.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.523 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 4.8 t70 -87.45 112.35 22.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.845 177.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -86.81 111.37 20.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.076 0.465 . . . . 0.0 110.595 -177.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 mtmm -105.02 138.58 19.55 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.555 176.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.558 ' HG3' HD22 ' A' ' 66' ' ' LEU . 76.3 Cg_exo . . . . . 0 C--O 1.235 0.339 0 C-N-CA 123.338 2.692 . . . . 0.0 112.951 -177.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.429 ' HA ' ' HD2' ' A' ' 19' ' ' TYR . 7.9 mt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.788 0.327 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -66.07 -32.83 74.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.962 0.41 . . . . 0.0 110.853 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -69.65 -50.22 46.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.681 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.429 ' HD2' ' HA ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -62.87 -34.63 77.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.008 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.55 87.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.062 0.458 . . . . 0.0 110.246 175.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.54 -33.02 75.73 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.234 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -60.69 -36.02 77.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.867 0.365 . . . . 0.0 110.78 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.459 HD12 ' HA ' ' A' ' 23' ' ' ILE . 0.4 OUTLIER -62.61 -40.72 89.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.41 0.624 . . . . 0.0 109.404 177.837 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.462 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 13.1 mttt -66.06 -48.06 72.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.298 178.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 m -54.22 -36.73 63.8 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.798 0.332 . . . . 0.0 111.6 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.85 86.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.011 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -77.18 -42.11 31.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.439 -177.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 59.2 mt-10 -55.33 -38.62 68.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.677 -177.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.64 15.34 14.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.886 -176.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.433 ' HD3' ' HB3' ' A' ' 76' ' ' LEU . 67.9 mttt -151.4 33.48 0.57 Allowed 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.8 p90 . . . . . 0 N--CA 1.438 -1.057 0 CA-C-N 113.887 -1.506 . . . . 0.0 113.316 -167.64 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.531 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.5 139.01 45.15 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.87 107.99 4.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.985 0.421 . . . . 0.0 111.151 -176.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.4 m -74.97 112.91 11.68 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.2 mt -103.69 122.48 45.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.934 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.58 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -78.63 102.95 8.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.888 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.747 HD12 ' HB2' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -101.29 110.33 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.279 -176.933 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -101.98 98.39 8.61 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.93 177.814 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.04 131.24 46.12 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.269 0.557 . . . . 0.0 111.07 -174.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.85 153.66 85.01 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.691 176.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.06 -27.01 34.6 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.186 2.591 . . . . 0.0 113.296 -178.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -77.35 -5.07 48.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.244 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.15 42.21 6.75 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.642 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -127.82 149.39 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 177.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.43 105.64 12.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.451 ' HG ' ' HB3' ' A' ' 47' ' ' LYS . 1.5 pp -88.19 -24.28 23.34 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.504 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.529 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 26.0 t0 -154.68 111.09 3.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.977 179.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -121.51 106.6 18.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -133.66 129.12 20.27 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -172.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 12.6 Cg_exo -66.68 127.07 16.44 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.557 2.171 . . . . 0.0 110.919 175.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -90.28 -65.77 0.99 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.251 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.67 145.82 13.98 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.639 -0.791 . . . . 0.0 111.72 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 151.82 -136.16 5.35 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.866 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.51 119.21 59.41 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -53.53 -41.16 75.65 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.988 2.459 . . . . 0.0 113.064 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.67 -48.79 53.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.671 0.272 . . . . 0.0 110.933 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.8 tp -59.09 -46.39 88.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.693 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.5 m -61.4 -42.03 98.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.266 -177.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -40.2 94.96 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.723 0.296 . . . . 0.0 110.822 179.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.05 -38.75 82.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.577 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.23 -36.53 82.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.023 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.693 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 45.3 mt -60.63 -45.1 95.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.696 177.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.1 -43.89 90.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.13 -48.71 77.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.115 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.5 -24.45 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.401 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -67.19 -38.13 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.012 0.434 . . . . 0.0 110.426 178.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.441 ' HA ' HD13 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -91.69 -17.75 24.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.707 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.27 138.17 58.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.189 -177.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.469 ' HA ' ' HD2' ' A' ' 78' ' ' LYS . 0.4 OUTLIER -82.25 86.36 6.67 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.005 178.638 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 30.5 mm -82.61 121.02 77.74 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.865 178.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -82.07 146.78 14.52 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.485 2.124 . . . . 0.0 112.219 -176.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.52 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -61.64 147.91 87.8 Favored Pre-proline 0 N--CA 1.446 -0.655 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.418 178.597 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.93 112.64 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.653 2.902 . . . . 0.0 113.524 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.53 -26.97 13.48 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.701 2.267 . . . . 0.0 112.284 -177.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.8 152.62 38.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.107 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -63.38 -34.98 78.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.862 -176.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.58 67.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.065 0.46 . . . . 0.0 110.77 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 88.1 t -68.37 -32.2 54.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.096 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.404 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -59.77 -42.11 92.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.986 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.488 ' H ' ' HG2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -79.81 -39.1 31.51 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.044 -0.262 . . . . 0.0 111.488 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.2 t -70.22 -46.46 71.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.501 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 0.1 OUTLIER -63.54 -13.95 46.42 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.586 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 88' ' ' TYR . 18.1 mtmt -69.13 -5.83 24.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.861 0.362 . . . . 0.0 110.695 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -169.2 69.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.501 ' HB1' ' HA ' ' A' ' 91' ' ' PHE . . . -127.51 84.37 63.56 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.529 -174.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.58 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 11.5 Cg_exo -74.24 105.8 2.1 Favored 'Trans proline' 0 CA--C 1.53 0.322 0 C-N-CA 123.158 2.572 . . . . 0.0 111.8 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.747 ' HB2' HD12 ' A' ' 46' ' ' ILE . 2.7 mp -89.57 150.67 22.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.997 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.441 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 1.7 t0 -92.59 97.26 10.7 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -68.37 128.16 35.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.197 0.522 . . . . 0.0 111.418 -175.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.84 112.02 18.79 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.345 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--O 1.233 0.227 0 C-N-CA 123.141 2.56 . . . . 0.0 111.89 -178.557 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.448 ' O ' HG22 ' A' ' 16' ' ' ILE . 49.5 mm . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.543 0.211 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -57.64 -47.1 83.17 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -65.17 -44.81 87.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.715 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -44.43 96.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.701 178.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.53 95.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.806 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.49 -43.87 97.51 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.981 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -66.79 -38.52 86.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.535 0.207 . . . . 0.0 111.04 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.481 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 63.6 mt -65.32 -48.55 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.866 0.365 . . . . 0.0 110.576 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -63.37 -24.93 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.142 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 m -78.77 -45.43 21.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.439 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.96 -40.81 73.77 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.238 0.542 . . . . 0.0 110.879 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 5.8 mt -61.69 -46.18 97.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.048 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.56 -21.13 63.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.522 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -68.59 -11.76 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.873 0.368 . . . . 0.0 110.664 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.433 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 3.1 mptp? -103.41 -47.07 4.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.028 176.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.157 176.898 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -121.06 107.69 12.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.776 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.581 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.3 OUTLIER -104.95 114.6 28.91 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.978 0.418 . . . . 0.0 111.04 -177.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -86.9 99.12 11.62 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.182 176.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.2 mt -85.39 113.03 21.38 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.865 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -74.65 112.67 11.08 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.254 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.639 HD11 ' HB2' ' A' ' 96' ' ' LEU . 1.3 pt -131.88 123.05 50.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.815 -171.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 mtmm -102.68 98.93 8.89 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.58 HD23 ' HD2' ' A' ' 91' ' ' PHE . 4.9 tp -93.62 113.07 25.08 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.045 0.45 . . . . 0.0 110.343 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.64 150.08 87.36 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.226 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.763 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 16.3 Cg_endo -58.28 -6.94 3.3 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 123.206 2.604 . . . . 0.0 113.086 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.91 -4.11 56.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.734 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.4 62.65 2.04 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.54 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.99 139.58 9.95 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.442 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -88.93 104.84 17.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.87 0.367 . . . . 0.0 111.0 -178.065 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.09 -37.94 28.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.155 0.502 . . . . 0.0 109.966 177.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -124.51 121.95 36.26 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.108 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.436 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 4.2 tt -143.35 110.35 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.879 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -140.79 143.39 31.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.356 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.498 ' HG3' HD23 ' A' ' 71' ' ' LEU . 8.8 Cg_exo -70.54 103.73 1.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.246 1.964 . . . . 0.0 111.33 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -70.33 -49.67 47.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.055 0.455 . . . . 0.0 110.025 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -173.71 137.74 4.21 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.843 177.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.581 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 168.61 -102.7 0.19 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.429 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -143.01 128.15 9.97 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -55.48 -37.22 95.14 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.799 2.333 . . . . 0.0 112.907 -177.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.99 -48.95 16.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.6 tp -63.33 -45.04 93.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.454 ' O ' HD22 ' A' ' 71' ' ' LEU . 4.1 m -65.39 -43.89 89.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.795 -175.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -57.33 -49.81 74.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.742 0.306 . . . . 0.0 110.739 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.66 -29.17 70.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.662 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.16 -51.58 8.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.532 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.498 HD23 ' HG3' ' A' ' 59' ' ' PRO . 0.9 OUTLIER -65.31 -39.22 92.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.318 -176.135 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.539 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . . . -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.1 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.06 -33.45 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.427 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.0 -28.89 68.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.539 ' HD2' ' HA ' ' A' ' 72' ' ' ALA . 8.9 mttm -71.75 -22.78 61.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.071 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.433 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -100.95 -19.97 15.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.174 -177.548 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.41 132.94 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.562 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 91.23 8.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.518 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.449 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 38.7 mm -72.22 121.64 85.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.359 179.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 29.5 Cg_exo -64.11 153.19 77.64 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.823 2.349 . . . . 0.0 112.042 -177.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 135.25 88.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 116.21 3.03 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.124 2.55 . . . . 0.0 113.179 -173.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -79.64 -50.01 0.07 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.655 2.237 . . . . 0.0 112.157 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.85 156.8 23.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.772 0.32 . . . . 0.0 110.863 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.89 -27.48 57.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.932 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 90' ' ' VAL . . . -60.76 -40.77 93.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.69 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.433 ' HA ' HD11 ' A' ' 16' ' ' ILE . 9.2 t -61.9 -42.55 95.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.528 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 0.7 OUTLIER -58.79 -32.26 69.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.524 178.472 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.474 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 2.7 mm-40 -75.91 -30.23 58.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.885 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 86' ' ' ALA . 5.4 t -92.42 -53.42 8.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -173.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.763 ' HZ ' ' HA ' ' A' ' 50' ' ' PRO . 0.1 OUTLIER -61.72 -13.11 20.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -168.707 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.474 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.3 ptpt -75.33 -13.63 60.43 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.952 -177.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -169.21 22.16 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.464 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -121.38 123.64 27.57 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 121.752 -0.592 . . . . 0.0 111.27 177.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.865 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.3 Cg_exo -72.7 156.78 53.06 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.191 2.594 . . . . 0.0 112.204 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.639 ' HB2' HD11 ' A' ' 46' ' ' ILE . 0.6 OUTLIER -95.75 132.79 40.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.419 -175.456 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 112.64 19.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.305 174.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -106.35 122.78 46.95 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.296 0.569 . . . . 0.0 110.843 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.551 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -150.66 163.32 24.38 Favored Pre-proline 0 C--N 1.312 -1.024 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.499 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.551 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 5.9 Cg_exo . . . . . 0 C--N 1.348 0.529 0 C-N-CA 123.647 2.898 . . . . 0.0 112.324 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.408 ' HA ' HG23 ' A' ' 87' ' ' VAL . 13.9 mt . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.922 0.391 . . . . 0.0 110.365 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -34.05 70.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.112 0.482 . . . . 0.0 109.926 177.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -63.81 -39.74 94.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.881 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.43 -40.34 82.24 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.083 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.86 -49.67 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.266 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.78 -31.58 73.21 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.052 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -34.12 70.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.606 0.241 . . . . 0.0 110.676 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 60.0 mt -66.39 -41.44 88.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.13 83.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.821 176.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 m -66.79 -38.14 85.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 0.0 110.569 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.04 -34.95 77.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.214 0.531 . . . . 0.0 110.779 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.492 HD12 HG23 ' A' ' 27' ' ' ILE . 5.5 mt -83.32 -56.25 6.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.626 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 31' ' ' PHE . 43.6 mt-10 -75.48 -22.32 57.32 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.595 -170.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -80.42 8.48 7.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.698 -0.627 . . . . 0.0 110.288 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.98 12.39 11.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 172.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.431 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.508 -177.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.2 mmtt . . . . . 0 C--O 1.232 0.182 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.26 138.7 40.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.885 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.44 93.38 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.159 0.504 . . . . 0.0 111.65 -176.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.6 m -76.49 113.78 14.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.216 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.22 125.62 54.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 177.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.934 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 12.4 ttm105 -78.48 98.35 6.03 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.023 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -105.33 155.32 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.256 -176.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.67 103.08 5.11 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.004 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.497 HD23 ' HA ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -81.82 138.43 35.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.973 0.415 . . . . 0.0 110.991 -177.904 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.526 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.82 163.76 17.43 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.638 176.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.526 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 33.3 Cg_endo -62.43 -11.89 25.07 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.348 2.032 . . . . 0.0 112.062 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.41 -4.35 59.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.912 177.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.96 10.55 84.86 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.606 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.46 154.12 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.744 0.307 . . . . 0.0 110.473 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.36 102.07 14.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.093 179.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.2 -42.78 93.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.143 0.497 . . . . 0.0 110.248 -179.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -128.31 144.26 51.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.2 tt -158.1 106.34 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.365 0.602 . . . . 0.0 109.408 177.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.45 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -135.15 123.63 15.82 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.032 -174.029 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.575 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 21.6 Cg_exo -65.64 120.7 7.93 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.974 2.449 . . . . 0.0 112.15 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -61.86 1.86 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -166.63 -176.71 37.95 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.029 177.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.5 -89.22 0.43 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 -178.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -133.91 110.29 12.01 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 120.78 0.324 . . . . 0.0 110.518 176.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.99 -36.08 95.43 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 122.717 2.278 . . . . 0.0 112.787 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.84 -53.09 12.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.307 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.915 0.388 . . . . 0.0 110.9 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.575 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 8.5 m -64.74 -42.59 95.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.606 -178.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -68.82 -33.59 74.09 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.933 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.54 69.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 178.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.07 71.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 15.2 mt -61.16 -37.06 81.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.788 0.327 . . . . 0.0 111.14 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.27 -40.93 77.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.873 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.13 74.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.035 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.56 -26.91 68.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.383 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -78.05 -22.74 48.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mt -99.39 -11.4 21.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.501 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.11 125.69 27.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.278 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.91 99.14 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.812 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -112.89 124.72 31.11 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.616 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.7 168.41 19.5 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.55 2.167 . . . . 0.0 112.651 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -66.92 127.73 93.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -50.86 110.84 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.31 2.673 . . . . 0.0 112.577 -177.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.74 -27.86 12.16 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.62 2.214 . . . . 0.0 111.457 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.6 ' HB2' HG22 ' A' ' 87' ' ' VAL . 0.6 OUTLIER -107.54 120.05 41.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.154 177.865 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -60.99 -32.07 71.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.12 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.68 78.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.92 0.391 . . . . 0.0 110.913 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 84' ' ' SER . 91.0 t -66.6 -44.62 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -62.41 -43.38 98.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.969 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.795 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 3.3 mm-40 -58.05 -32.52 68.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.31 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.23 -58.2 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.452 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -65.43 -18.94 65.71 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.795 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.73 -13.81 61.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.816 0.341 . . . . 0.0 110.918 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -153.08 46.78 0.69 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 110.695 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.82 101.3 11.7 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.812 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.934 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.6 Cg_exo -72.45 131.75 18.03 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.848 2.365 . . . . 0.0 111.53 -178.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.66 146.03 25.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.251 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -97.07 96.71 8.66 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.967 175.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -73.16 108.86 6.29 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.419 -173.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.69 135.73 25.43 Favored Pre-proline 0 C--N 1.315 -0.902 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--N 1.346 0.409 0 C-N-CA 123.913 3.075 . . . . 0.0 113.388 -175.693 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mt . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -63.36 -37.89 89.04 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -175.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -33.84 76.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.028 0.442 . . . . 0.0 110.413 178.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -73.67 -48.7 30.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.697 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.532 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.81 -34.19 77.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.993 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.14 -35.95 91.19 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.191 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -65.85 -42.56 90.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.845 0.355 . . . . 0.0 110.994 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.532 HD12 ' HA ' ' A' ' 20' ' ' ALA . 44.8 mt -57.93 -44.29 86.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.37 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.2 mttp -55.16 -44.27 75.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.541 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.55 -36.67 44.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.975 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.17 -38.31 79.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.677 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 23' ' ' ILE . 6.3 mt -65.43 -38.32 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.985 -178.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -19.28 62.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.415 177.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -68.99 -23.64 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.149 0.5 . . . . 0.0 110.04 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 14.6 mmmt -96.18 -48.38 5.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.572 174.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.852 176.357 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.99 145.33 48.23 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.8 106.49 4.26 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.693 -177.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 20.0 m -78.94 113.33 16.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.661 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -108.63 114.25 27.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.196 -176.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.867 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 21.8 ttm180 -79.42 89.07 5.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.7 pt -95.28 111.88 26.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.569 -172.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -93.94 99.44 11.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.37 177.191 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.9 mt -85.33 139.51 31.52 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.126 0.489 . . . . 0.0 111.379 -175.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -96.0 158.8 33.55 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.279 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.706 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 32.4 Cg_exo -56.0 -24.09 46.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.966 2.444 . . . . 0.0 112.564 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -75.19 -9.08 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.127 -178.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 44.75 6.48 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.774 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 ptt? -150.81 142.46 23.63 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.649 HD11 ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -88.54 101.58 14.08 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.352 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.433 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 0.1 OUTLIER -71.87 -37.22 70.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.409 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.1 t70 -123.73 100.13 6.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -111.57 106.18 20.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -113.94 119.96 39.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.611 -170.347 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.573 ' HG3' HD21 ' A' ' 71' ' ' LEU . 2.7 Cg_exo -71.51 110.9 2.98 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.694 2.263 . . . . 0.0 111.176 175.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -73.8 -49.21 26.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.209 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 173.22 172.9 39.17 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.472 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.8 -90.66 0.24 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -143.45 112.34 5.5 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.32 -35.01 95.44 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.953 2.435 . . . . 0.0 112.275 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.81 83.38 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.283 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.0 tp -88.05 -40.4 13.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.626 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.588 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.6 m -60.64 -55.07 37.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.298 -175.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.489 ' HA ' HD13 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -61.99 -29.72 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.681 0.277 . . . . 0.0 111.455 -176.51 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.95 -44.06 27.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.928 0.394 . . . . 0.0 110.851 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.99 -28.97 69.94 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.464 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 91.2 mt -54.58 -44.84 73.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.652 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.6 -41.19 32.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.68 -50.05 74.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.99 -177.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.19 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.85 0.357 . . . . 0.0 111.49 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.649 ' HG2' HD11 ' A' ' 54' ' ' LEU . 2.8 mtmt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 179.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.7 mp -94.6 -19.76 20.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.878 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.44 158.4 26.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.673 -175.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.03 73.84 5.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.685 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 22.9 mm -76.3 120.07 80.04 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.712 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -63.58 171.56 6.74 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.594 2.196 . . . . 0.0 112.339 -177.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.452 ' HG3' ' HD2' ' A' ' 82' ' ' PRO . 1.1 tppt? -90.98 135.01 29.14 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 175.162 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.452 ' HD2' ' HG3' ' A' ' 81' ' ' LYS . 78.4 Cg_exo -44.16 111.57 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.396 2.731 . . . . 0.0 112.785 -178.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -62.99 -66.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.721 2.28 . . . . 0.0 112.25 -176.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.33 -179.37 3.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.778 0.323 . . . . 0.0 110.637 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -16.49 61.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.073 -177.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.31 -57.8 9.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.467 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.7 t -60.51 -37.57 75.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.63 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.706 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 29.3 t80 -54.0 -52.83 59.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.636 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.501 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 44.6 mm-40 -77.89 -40.81 38.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 111.534 -177.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.497 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 54.5 t -72.68 -52.56 22.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.981 -173.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -72.69 -5.21 36.03 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -176.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 7.4 mtmt -65.92 -21.34 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 171.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.87 55.37 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.709 179.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.497 ' HB2' ' O ' ' A' ' 90' ' ' VAL . . . -123.26 93.53 47.89 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -178.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.867 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.4 Cg_exo -73.73 140.08 28.78 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 123.013 2.475 . . . . 0.0 111.941 -178.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.35 135.08 55.14 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.57 -177.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.584 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 25.5 t0 -84.09 103.32 13.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 175.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.61 108.62 3.92 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.082 -175.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.9 116.82 32.69 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.536 176.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 C--N 1.35 0.612 0 C-N-CA 124.103 3.202 . . . . 0.0 113.356 -177.33 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.584 HG22 ' HE1' ' A' ' 91' ' ' PHE . 1.3 mt . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 120.899 0.38 . . . . 0.0 111.6 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -35.36 78.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.973 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -66.47 -48.36 70.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.73 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.45 80.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.298 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.19 -35.56 77.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.765 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.79 -37.12 88.28 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.571 177.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.06 -37.15 86.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.889 0.376 . . . . 0.0 110.632 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 36.1 mt -73.29 -40.07 56.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.409 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.72 -38.0 71.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.433 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.54 -42.81 28.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.867 0.365 . . . . 0.0 110.704 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.61 -47.31 86.07 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.406 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.494 HD12 ' CZ ' ' A' ' 98' ' ' PHE . 4.6 mt -64.39 -39.33 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.311 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -21.18 64.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.459 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.439 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 4.3 m -96.53 17.81 15.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.117 0.484 . . . . 0.0 110.691 177.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 29' ' ' SER . 10.1 mmtt -150.81 32.14 0.62 Allowed 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.4 p90 . . . . . 0 N--CA 1.436 -1.158 0 CA-C-N 113.487 -1.688 . . . . 0.0 113.013 -167.827 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.505 ' HB2' HD23 ' A' ' 66' ' ' LEU . 23.2 mttm . . . . . 0 N--CA 1.452 -0.364 0 CA-C-O 120.733 0.301 . . . . 0.0 110.38 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.17 149.09 39.27 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.404 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 33.4 t -152.37 116.6 4.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.041 0.448 . . . . 0.0 111.816 -178.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.875 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.9 m -76.03 121.43 22.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.42 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 59' ' ' PRO . 12.7 mt -105.61 129.48 53.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 0.0 110.252 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.592 ' HB3' ' HD2' ' A' ' 58' ' ' LYS . 8.6 ttt-85 -86.86 93.3 9.26 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.82 113.68 34.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.304 -173.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -101.01 100.86 11.53 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 175.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 91' ' ' PHE . 35.2 mt -93.15 130.03 38.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.947 -175.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.39 138.72 67.57 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 172.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.65 -17.82 18.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.349 2.699 . . . . 0.0 113.342 -175.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -81.32 -0.41 40.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.328 . . . . 0.0 111.174 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.67 63.88 1.52 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.564 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.8 ptp -159.68 135.61 8.68 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.489 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -91.26 87.82 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.155 0.503 . . . . 0.0 110.043 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.46 ' HG ' ' N ' ' A' ' 56' ' ' ASP . 0.4 OUTLIER -76.59 -29.43 56.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.378 -178.661 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.46 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 29.7 t70 -130.52 92.52 3.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.38 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 tt -124.36 106.71 17.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.592 ' HD2' ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -134.3 142.6 43.6 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.47 -173.14 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.473 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 8.9 Cg_exo -69.82 132.29 22.92 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.055 2.503 . . . . 0.0 111.504 177.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -98.98 -76.58 0.53 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.418 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -133.14 145.69 17.67 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.467 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 135.69 -154.26 21.71 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.187 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -88.53 120.46 70.32 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -56.01 -27.27 63.31 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.99 2.46 . . . . 0.0 112.859 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.29 -42.64 75.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.706 0.289 . . . . 0.0 110.43 176.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.505 HD23 ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.716 174.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 8.8 m -63.07 -56.23 18.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.506 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -38.11 84.91 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.602 -174.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.53 -41.8 92.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.216 177.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.82 -38.98 87.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.021 177.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 17.8 mt -57.1 -51.35 69.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.929 0.395 . . . . 0.0 110.859 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.44 -44.01 92.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.033 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.448 ' HB2' ' CG2' ' A' ' 27' ' ' ILE . . . -64.74 -40.42 95.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.443 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.93 -33.8 76.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.73 0.3 . . . . 0.0 111.293 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.42 -26.32 60.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.01 0.433 . . . . 0.0 110.635 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -88.01 -31.92 19.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.701 179.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.99 170.63 12.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.354 0.597 . . . . 0.0 111.821 -176.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -114.87 106.3 14.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.552 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.447 HD11 HD22 ' A' ' 54' ' ' LEU . 3.6 mp -103.77 110.4 63.86 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.9 Cg_exo -69.63 153.25 69.78 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.842 2.361 . . . . 0.0 112.558 -175.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -70.54 126.99 92.39 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.501 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.94 112.32 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.954 2.436 . . . . 0.0 113.218 -175.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -77.52 -21.34 11.6 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.62 2.213 . . . . 0.0 111.33 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -97.66 143.25 28.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.074 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.8 mm-40 -72.17 -27.62 62.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.758 0.313 . . . . 0.0 110.862 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.57 -52.03 65.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.284 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 91' ' ' PHE . 53.3 t -67.49 -37.15 78.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.627 177.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.457 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 4.8 t80 -53.72 -50.87 64.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.355 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.433 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.29 -27.12 47.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.093 -174.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.2 t -87.19 -43.01 15.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.896 -0.321 . . . . 0.0 111.507 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.584 ' HE1' HG22 ' A' ' 16' ' ' ILE . 2.5 m-85 -77.8 -0.87 28.78 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -174.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 88' ' ' TYR . 8.5 mttt -57.29 -30.35 64.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.214 0.53 . . . . 0.0 110.478 176.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.518 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 2.8 t-20 -158.3 76.08 0.75 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.465 172.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -107.68 95.35 14.06 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.342 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.518 ' HD3' ' O ' ' A' ' 93' ' ' ASN . 8.0 Cg_exo -73.6 104.5 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.651 2.234 . . . . 0.0 110.448 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.8 130.47 46.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.783 -173.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.875 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 32.9 t70 -75.13 102.1 4.81 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.494 ' CZ ' HD12 ' A' ' 27' ' ' ILE . 0.8 OUTLIER -70.38 116.98 11.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.37 0.605 . . . . 0.0 110.48 -175.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 4.7 tttt -131.62 128.05 21.67 Favored Pre-proline 0 C--N 1.312 -1.046 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.655 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 99' ' ' LYS . 3.2 Cg_exo . . . . . 0 C--N 1.349 0.6 0 C-N-CA 124.861 3.707 . . . . 0.0 111.837 177.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.8 mt . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.556 0.217 . . . . 0.0 111.45 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.69 -39.97 86.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.987 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -71.96 -41.47 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.037 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.9 -40.02 96.28 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.76 -37.33 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.783 177.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.24 -39.58 43.69 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.386 178.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.407 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -62.68 -26.46 68.67 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.285 0.234 . . . . 0.0 111.429 -178.291 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.407 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 65.2 mt -62.91 -39.22 84.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.233 0.539 . . . . 0.0 110.03 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -74.07 -28.99 61.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.179 178.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -67.7 -39.33 84.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.725 0.298 . . . . 0.0 110.691 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.76 -31.78 68.67 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.476 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.516 HG22 ' HB3' ' A' ' 73' ' ' ALA . 43.2 mt -66.18 -31.65 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.665 -176.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.69 -33.1 68.53 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.108 -0.37 . . . . 0.0 111.108 179.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.24 4.8 1.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.761 178.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 1.6 mmmt -119.36 -0.54 10.92 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.446 ' CE2' ' HB2' ' A' ' 69' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.572 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.384 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.301 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.1 m -118.13 121.2 39.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.911 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 6.0 t -115.91 151.09 36.0 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -137.56 102.2 4.7 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 0.0 110.387 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.14 136.12 41.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.409 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.798 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 ptm180 -85.21 124.91 32.4 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -127.7 111.09 23.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 121.167 0.508 . . . . 0.0 111.168 -173.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.62 ' HG3' ' O ' ' A' ' 92' ' ' LYS . 29.1 ttmt -108.0 104.22 13.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.373 -0.83 . . . . 0.0 108.891 176.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 tp -96.37 142.55 28.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.145 0.498 . . . . 0.0 111.898 -173.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -100.19 166.13 13.24 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.824 176.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -61.81 -10.15 16.28 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.756 2.304 . . . . 0.0 112.703 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.35 -6.61 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.477 177.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.428 ' HA3' ' HA ' ' A' ' 81' ' ' LYS . . . 78.36 16.92 78.8 Favored Glycine 0 CA--C 1.51 -0.25 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.89 -177.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -104.84 146.25 29.26 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.44 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -90.12 101.74 14.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -28.06 60.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.094 0.473 . . . . 0.0 110.07 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.552 ' HB3' ' HB3' ' A' ' 47' ' ' LYS . 28.7 t70 -128.93 104.15 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.538 175.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -133.76 111.74 15.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.34 148.09 15.19 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.408 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.531 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 39.3 Cg_endo -70.34 112.91 3.3 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 121.964 1.776 . . . . 0.0 111.656 177.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -73.45 -34.85 65.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.411 0.624 . . . . 0.0 109.589 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 176.88 -177.23 48.2 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.401 177.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.25 -150.84 17.43 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.013 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.3 112.55 42.3 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.784 0.326 . . . . 0.0 110.303 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.46 -40.26 82.54 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.339 2.693 . . . . 0.0 113.399 -174.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.0 -46.71 86.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.951 0.405 . . . . 0.0 111.188 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.409 ' HA ' HD11 ' A' ' 66' ' ' LEU . 16.3 tp -65.61 -38.9 90.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.553 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.531 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 24.9 m -67.93 -44.72 76.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.265 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.511 ' HA ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -62.17 -38.77 90.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.702 0.286 . . . . 0.0 110.822 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.446 ' HB2' ' CE2' ' A' ' 31' ' ' PHE . . . -60.73 -44.76 96.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.642 178.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.3 82.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.075 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.511 HD11 ' HA ' ' A' ' 68' ' ' GLN . 51.7 mt -53.52 -46.64 70.18 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.708 -177.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.13 -37.24 46.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HB3' HG22 ' A' ' 27' ' ' ILE . . . -75.64 -39.6 57.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.112 -175.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.411 ' HA ' ' HB2' ' A' ' 77' ' ' ALA . . . -63.55 -32.01 73.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -176.415 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -67.91 -30.56 69.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.0 110.966 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 57.3 mt -98.23 -2.59 39.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.541 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -78.02 149.07 34.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.442 -179.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.95 66.45 6.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -178.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 53.4 mt -78.51 116.71 61.53 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.878 176.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 23.4 Cg_exo -67.29 151.53 80.66 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 123.011 2.474 . . . . 0.0 112.761 -175.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.496 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -73.86 138.62 76.52 Favored Pre-proline 0 N--CA 1.443 -0.821 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.453 175.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.04 106.92 0.22 Allowed 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.114 2.543 . . . . 0.0 112.835 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -77.16 -25.1 8.96 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.601 2.201 . . . . 0.0 111.832 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.42 135.26 54.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.695 177.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -66.51 -27.83 68.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.956 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.4 -37.26 86.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.141 0.496 . . . . 0.0 110.75 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.99 -33.92 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.292 177.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -69.66 -31.63 69.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.514 176.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.884 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -65.9 -35.38 80.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.396 179.295 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.472 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 51.6 t -79.69 -45.89 22.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.566 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.29 5.32 8.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.178 -176.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.884 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 6.1 ttmt -63.7 -23.69 67.47 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.229 0.538 . . . . 0.0 110.117 176.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -170.07 75.15 0.08 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.292 175.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 90' ' ' VAL . . . -122.09 85.2 46.02 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.452 -173.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.798 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 12.6 Cg_exo -73.05 104.51 1.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.747 2.298 . . . . 0.0 110.725 178.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 41.6 mt -95.24 158.84 15.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.823 -172.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -80.07 146.67 31.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.258 177.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.471 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 64.7 t80 -129.55 130.84 46.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.029 0.443 . . . . 0.0 110.507 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 165.6 34.23 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo . . . . . 0 C--N 1.344 0.333 0 C-N-CA 122.406 2.07 . . . . 0.0 113.202 -178.013 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -99.43 -8.77 24.27 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.641 -172.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.429 ' HD2' HG23 ' A' ' 6' ' ' THR . 32.1 m-85 67.81 174.78 0.27 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.9 176.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.49 -15.39 53.28 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -159.27 94.53 1.19 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.074 0.464 . . . . 0.0 109.779 178.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.429 HG23 ' HD2' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -84.26 -30.68 25.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.01 -176.63 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.23 -68.58 0.32 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.235 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -153.42 65.78 0.76 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.341 0.591 . . . . 0.0 109.658 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -131.45 -178.41 4.84 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.031 -178.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 113.81 2.62 23.84 Favored Glycine 0 N--CA 1.445 -0.748 0 C-N-CA 120.583 -0.817 . . . . 0.0 111.397 -176.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -165.67 23.25 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.878 0.371 . . . . 0.0 110.638 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.42 -22.94 21.19 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.995 0.426 . . . . 0.0 110.854 -178.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 116.29 -48.78 0.91 Allowed Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.666 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.08 -18.57 65.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.751 0.31 . . . . 0.0 111.174 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -47.33 62.06 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.813 175.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.5 mt -68.77 -39.49 80.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.225 176.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -62.91 -26.88 69.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.91 178.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.256 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.07 -31.11 69.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.469 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.31 64.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.288 0.566 . . . . 0.0 109.879 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.21 -32.28 72.39 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.833 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.45 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -60.06 -30.16 69.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.98 0.39 . . . . 0.0 110.894 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.541 ' O ' HG13 ' A' ' 27' ' ' ILE . 2.6 mt -76.36 -35.12 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.024 0.44 . . . . 0.0 109.954 176.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -62.28 -46.53 88.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.002 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.0 -34.46 75.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.232 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.39 -32.45 72.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.391 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 23' ' ' ILE . 8.5 mt -67.97 -32.81 57.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.707 -176.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.488 ' OE1' ' HB2' ' A' ' 101' ' ' HIS . 0.1 OUTLIER -65.15 -40.08 93.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.639 0.257 . . . . 0.0 111.208 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.41 14.13 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -119.26 -8.55 10.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 176.978 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.551 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -122.71 -64.73 1.16 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.723 176.076 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.565 ' C ' ' H ' ' A' ' 34' ' ' ALA . 0.2 OUTLIER 161.44 -154.87 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 -177.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -86.62 23.59 1.63 Allowed 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 160.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.565 ' H ' ' C ' ' A' ' 32' ' ' TYR . . . -78.03 -35.44 49.77 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 112.925 -1.943 . . . . 0.0 109.942 176.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.9 -17.48 64.92 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.497 176.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.6 m -81.72 65.77 6.99 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.034 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.443 ' HB3' ' H ' ' A' ' 38' ' ' ALA . 0.1 OUTLIER -86.41 -142.63 0.1 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.462 175.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.629 ' HA ' ' HG2' ' A' ' 100' ' ' PRO . . . -176.13 157.28 1.8 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.853 0.359 . . . . 0.0 111.049 172.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.15 30.52 69.62 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.876 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -135.06 162.78 31.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.895 0.379 . . . . 0.0 110.876 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -141.14 139.66 33.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.785 176.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 52.8 t -138.05 79.6 1.75 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.47 0.652 . . . . 0.0 110.823 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -70.14 120.99 16.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.012 176.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 59' ' ' PRO . 67.0 mt -113.64 124.56 52.62 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.91 0.386 . . . . 0.0 110.666 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.529 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -81.02 88.17 5.96 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.481 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.3 pt -113.89 152.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.447 -174.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.582 ' HB2' ' HB2' ' A' ' 56' ' ' ASP . 5.0 mtmt -140.33 112.62 7.81 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.375 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 2.3 tp -95.55 118.65 32.65 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 120.915 0.388 . . . . 0.0 110.952 -177.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.425 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -67.57 159.05 80.47 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.979 176.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.48 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 37.4 Cg_exo -57.04 -15.91 19.15 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.864 2.376 . . . . 0.0 112.777 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.83 -0.93 57.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.327 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.52 52.94 4.89 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.52 -0.848 . . . . 0.0 112.426 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.71 140.61 23.78 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.416 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -86.16 107.54 17.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.006 0.431 . . . . 0.0 110.657 -178.722 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.425 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -76.6 -37.37 56.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.902 177.54 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.582 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -112.7 140.15 47.72 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.885 178.723 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -158.82 106.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.364 0.602 . . . . 0.0 110.128 177.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.404 ' HG3' ' HD2' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -140.43 127.05 12.02 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.191 -175.463 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.462 ' HA ' HD22 ' A' ' 44' ' ' LEU . 64.1 Cg_endo -76.62 111.08 3.18 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.701 2.267 . . . . 0.0 112.422 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -124.17 21.46 8.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.736 0.779 . . . . 0.0 109.957 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.433 ' HA2' ' HB ' ' A' ' 43' ' ' THR . . . -79.81 -151.84 7.04 Favored Glycine 0 C--N 1.32 -0.345 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.368 -177.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -115.85 -13.02 8.87 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.822 -0.704 . . . . 0.0 113.2 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -117.63 112.46 38.93 Favored Pre-proline 0 C--N 1.327 -0.403 0 O-C-N 122.551 -0.381 . . . . 0.0 110.466 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.445 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 36.7 Cg_endo -68.96 -27.38 30.43 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.691 2.261 . . . . 0.0 112.886 -176.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -77.71 -51.74 10.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.735 0.302 . . . . 0.0 110.85 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.8 tp -56.87 -44.05 81.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.387 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.612 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.2 m -69.76 -38.89 76.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.914 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.445 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 1.3 mp0 -62.18 -40.83 97.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.011 0.434 . . . . 0.0 110.888 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.72 55.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.032 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.62 -37.94 76.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.812 -178.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 22.0 mt -55.3 -44.03 75.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.771 0.32 . . . . 0.0 111.198 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.41 46.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.267 -178.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.83 91.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.554 -177.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.33 79.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 111.196 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.007 0.432 . . . . 0.0 110.967 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 mt -92.27 -3.6 55.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.694 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -80.08 168.3 19.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -100.56 106.63 18.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 110.906 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mp -119.35 116.89 33.44 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.104 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -78.96 172.44 14.95 Favored 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 122.733 2.289 . . . . 0.0 113.066 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 124.33 89.78 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.195 178.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 68.7 Cg_exo -53.61 114.99 2.02 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.236 2.624 . . . . 0.0 112.646 -178.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 7.2 Cg_endo -92.14 -75.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.351 2.701 . . . . 0.0 112.903 -174.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.35 134.63 56.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.804 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.77 -36.48 74.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.49 -176.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.01 -47.36 83.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.829 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 83.7 t -66.72 -43.62 89.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.441 178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.48 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 6.1 t80 -60.87 -41.58 96.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.116 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.441 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 16.4 mm-40 -62.92 -24.77 68.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 0.0 111.234 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 93.3 t -92.43 -45.01 14.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.624 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.414 ' HD1' ' HA ' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -59.95 -30.47 69.1 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -175.228 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 48' ' ' LEU . 3.1 ptpt -66.27 -8.22 23.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.731 0.3 . . . . 0.0 111.602 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -164.38 59.94 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.914 0.387 . . . . 0.0 110.114 176.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.75 89.2 22.72 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.171 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.529 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 2.3 Cg_endo -76.1 103.14 1.69 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.07 1.847 . . . . 0.0 110.399 175.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.0 mt -102.75 153.24 20.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.973 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.544 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -94.38 132.35 39.1 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.023 175.121 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.601 ' O ' ' HB3' ' A' ' 42' ' ' CYS . 82.4 m-85 -113.98 98.92 7.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.473 0.654 . . . . 0.0 110.075 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.653 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -112.23 173.99 2.57 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.608 177.822 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.653 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 35.5 Cg_exo -37.27 119.94 0.29 Allowed 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 123.092 2.528 . . . . 0.0 112.855 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.488 ' HB2' ' OE1' ' A' ' 28' ' ' GLU . 2.5 m80 -91.45 157.28 17.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.736 -172.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.7 p80 . . . . . 0 C--O 1.242 0.681 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.568 -177.258 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 121.408 0.623 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.509 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 0.5 OUTLIER -77.9 140.87 39.32 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.524 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -106.83 49.04 0.81 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.029 0.442 . . . . 0.0 110.236 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.19 -136.26 32.36 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 -175.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -144.45 124.72 13.77 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.67 0.271 . . . . 0.0 110.52 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.9 m 65.93 77.66 0.29 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.677 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -90.78 36.67 0.9 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.408 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -125.38 154.27 42.14 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.18 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.7 t-20 -163.75 95.2 0.79 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.974 0.416 . . . . 0.0 110.115 178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.15 -165.55 11.94 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.978 -177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -162.56 178.43 8.57 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.07 125.89 28.09 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.306 178.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 99.33 40.73 3.16 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -173.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 18' ' ' ASN . . . -60.86 -27.54 68.19 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 122.421 0.288 . . . . 0.0 111.526 -178.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -59.69 -55.64 31.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.193 0.521 . . . . 0.0 110.567 178.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -70.16 -42.74 79.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.121 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.32 -29.84 71.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.623 -177.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 21.8 t-20 -62.37 -46.22 89.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.875 0.369 . . . . 0.0 110.741 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.68 -28.91 51.2 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.831 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.63 -35.99 82.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 110.33 175.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.1 -33.88 84.71 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.796 177.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -45.72 92.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.2 mt -64.82 -45.68 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.798 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -60.33 -35.92 76.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.016 0.436 . . . . 0.0 110.948 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -72.81 -40.55 65.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.5 -38.48 77.74 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.739 0.78 . . . . 0.0 110.631 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.507 HD11 HG21 ' A' ' 27' ' ' ILE . 8.5 mt -66.04 -43.44 92.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.262 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.502 ' CG ' ' HB2' ' A' ' 35' ' ' SER . 0.8 OUTLIER -76.12 -22.12 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -178.082 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -26.21 60.78 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.839 177.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.419 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.32 -51.9 7.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.891 174.757 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -97.9 75.61 2.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.057 0.456 . . . . 0.0 110.006 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.24 -51.6 63.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.451 -1.249 . . . . 0.0 113.62 -170.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -102.93 -9.77 19.57 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 122.587 1.184 . . . . 0.0 110.968 -173.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.32 -56.55 4.26 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 113.445 -1.707 . . . . 0.0 111.824 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.502 ' HB2' ' CG ' ' A' ' 28' ' ' GLU . 46.4 m -73.41 -15.48 61.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.518 -173.152 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 p -87.97 49.12 1.74 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.135 0.493 . . . . 0.0 110.732 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -86.94 -65.86 0.97 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.661 -175.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.663 ' H ' ' HB2' ' A' ' 100' ' ' PRO . . . 72.26 173.56 0.3 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.807 -173.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.64 -50.78 4.47 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.9 -177.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -97.49 165.79 11.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.827 0.346 . . . . 0.0 111.234 -177.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.18 156.78 44.73 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.287 176.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.697 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 8.2 t -142.52 151.39 41.58 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.0 m -125.16 103.23 7.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.218 0.532 . . . . 0.0 110.907 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.475 HD11 ' HB1' ' A' ' 70' ' ' ALA . 63.8 mt -92.59 113.18 25.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.009 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.723 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.3 mmt-85 -81.73 88.17 6.29 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.2 pt -101.04 151.74 5.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.074 -174.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.534 ' HE2' ' HB3' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -134.7 89.17 2.51 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.92 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.582 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 1.6 tp -80.74 123.2 28.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.393 -172.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.48 ' HB3' HD22 ' A' ' 55' ' ' LEU . . . -74.31 152.29 87.95 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 173.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -57.37 -16.4 22.76 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.053 2.502 . . . . 0.0 112.58 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.88 -14.34 62.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.723 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.05 59.94 2.23 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.807 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.97 146.11 20.21 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.36 82.1 2.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.321 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.48 HD22 ' HB3' ' A' ' 49' ' ' ALA . 0.2 OUTLIER -73.9 -19.57 60.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 177.801 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.438 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -125.05 117.26 23.57 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.488 177.391 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.5 tt -159.46 111.03 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.499 . . . . 0.0 110.531 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.482 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -137.74 135.05 18.58 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.183 -177.238 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.721 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 2.0 Cg_endo -80.64 74.36 5.58 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.414 2.743 . . . . 0.0 111.308 177.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.575 ' HB2' ' HG3' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -65.37 -34.15 77.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.081 -175.503 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -144.16 163.38 27.77 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.099 177.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.671 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 109.84 179.77 20.83 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.181 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.11 123.41 87.22 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-O 120.352 0.12 . . . . 0.0 110.797 -179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -53.41 -46.05 36.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.327 2.685 . . . . 0.0 113.234 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.1 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.822 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.644 HD21 ' HG3' ' A' ' 100' ' ' PRO . 14.0 tp -59.82 -43.9 94.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.845 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.721 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 92.7 m -64.62 -37.74 88.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.828 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -63.07 -40.77 98.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.868 0.366 . . . . 0.0 110.896 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.31 -45.61 92.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.429 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.475 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -68.46 -31.27 70.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.424 179.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 23.1 mt -55.7 -52.26 64.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.124 0.488 . . . . 0.0 111.328 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -76.86 -36.69 56.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.986 -177.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.05 -46.65 83.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.734 -178.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.33 90.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.708 0.29 . . . . 0.0 111.58 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -71.31 -26.95 63.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.419 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.6 OUTLIER -92.95 -2.42 55.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.739 178.401 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.9 156.99 17.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.282 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -97.5 101.2 12.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.071 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.496 HG21 HD22 ' A' ' 48' ' ' LEU . 11.4 mm -88.54 115.59 63.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.795 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.31 130.76 35.36 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.537 2.158 . . . . 0.0 112.024 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.415 ' HG2' ' H ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -59.92 121.16 56.34 Favored Pre-proline 0 N--CA 1.445 -0.713 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.891 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.407 ' CB ' ' HB2' ' A' ' 88' ' ' TYR . 47.0 Cg_exo -39.17 104.62 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 124.307 3.338 . . . . 0.0 114.492 -173.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -83.58 -52.2 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.895 2.397 . . . . 0.0 111.843 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.66 126.46 31.04 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -66.47 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.167 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.404 ' O ' HG22 ' A' ' 90' ' ' VAL . . . -66.34 -43.22 86.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 174.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 1.8 t -62.48 -42.54 96.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.606 175.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.407 ' HB2' ' CB ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -60.87 -44.51 96.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.001 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.856 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -70.78 -21.24 62.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -175.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 86' ' ' ALA . 72.4 t -92.53 -55.0 6.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.699 0.285 . . . . 0.0 111.245 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.46 ' HE1' HD11 ' A' ' 96' ' ' LEU . 12.9 m-85 -67.48 -14.95 63.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -173.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.856 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 3.4 pttp -70.31 -6.01 32.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.018 0.437 . . . . 0.0 110.679 177.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -164.93 67.69 0.14 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.103 173.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.448 ' HB3' ' HA ' ' A' ' 91' ' ' PHE . . . -136.24 97.85 11.76 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.866 -176.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.723 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 13.2 Cg_exo -72.02 112.6 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.466 2.111 . . . . 0.0 110.262 178.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.46 HD11 ' HE1' ' A' ' 91' ' ' PHE . 11.8 mt -88.54 149.15 23.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.993 -168.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.61 126.51 34.55 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.585 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.697 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 19.4 t80 -98.54 102.8 14.65 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.1 0.476 . . . . 0.0 109.824 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -109.86 100.09 41.45 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 174.861 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.663 ' HB2' ' H ' ' A' ' 38' ' ' ALA . 2.6 Cg_endo -53.76 139.23 68.43 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 123.334 2.689 . . . . 0.0 113.191 -170.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -59.22 160.73 6.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.993 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.1 p80 . . . . . 0 C--O 1.246 0.914 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.423 174.45 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -103.34 135.7 44.48 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 178.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -105.68 94.3 5.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.868 0.366 . . . . 0.0 110.066 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.416 ' O ' ' HB3' ' A' ' 5' ' ' ASN . . . -79.38 62.7 4.04 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.828 -177.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 4' ' ' GLY . 4.0 t30 70.29 -60.65 0.48 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.433 0.693 . . . . 0.0 111.945 178.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -15.48 31.61 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 122.352 -0.218 . . . . 0.0 111.441 -176.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 62.98 80.36 0.23 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.245 -177.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 72.63 -70.62 0.16 Allowed 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.272 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -155.35 150.21 26.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.844 0.354 . . . . 0.0 110.583 177.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.56 100.26 0.22 Allowed Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.944 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.39 113.72 3.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.967 0.413 . . . . 0.0 111.006 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.49 -176.6 3.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.832 -178.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 98.9 169.93 31.07 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.492 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -105.95 -67.5 0.92 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.609 0.242 . . . . 0.0 110.55 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -57.42 11.79 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.578 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 95.8 mt -56.87 -44.61 82.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.416 -178.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -65.8 -41.73 91.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.167 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -62.5 -46.06 90.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.467 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.414 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -62.06 -48.11 81.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.772 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -63.66 -29.94 71.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.105 0.478 . . . . 0.0 110.862 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.35 -51.84 20.03 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.524 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 3.6 pt20 -66.12 -26.59 67.52 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.703 HG12 HD11 ' A' ' 79' ' ' ILE . 52.5 mt -64.08 -40.54 89.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 20' ' ' ALA . 3.6 mttp -63.93 -42.07 97.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.298 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 m -62.95 -47.18 84.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.942 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.78 -44.59 77.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.282 0.563 . . . . 0.0 110.545 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.425 HG22 ' CE1' ' A' ' 101' ' ' HIS . 1.2 mt -61.88 -42.0 92.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.378 -178.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.527 ' C ' ' H ' ' A' ' 30' ' ' LYS . 4.0 tm-20 -76.39 -27.7 56.46 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.254 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.3 m -76.9 24.48 0.16 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.561 0.696 . . . . 0.0 110.72 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.527 ' H ' ' C ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -133.34 -33.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.739 177.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.491 ' O ' ' HB1' ' A' ' 34' ' ' ALA . 1.0 OUTLIER -113.85 -25.98 8.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.59 -176.461 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.467 ' C ' ' H ' ' A' ' 34' ' ' ALA . 16.4 m-85 62.02 -121.13 0.71 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.509 0.723 . . . . 0.0 111.901 178.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -71.56 4.59 2.96 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.665 0.745 . . . . 0.0 112.062 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.491 ' HB1' ' O ' ' A' ' 31' ' ' PHE . . . -79.02 -46.07 18.91 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 113.84 -1.527 . . . . 0.0 109.805 169.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.526 ' HG ' ' HG2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -73.51 -21.75 60.31 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.984 178.665 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.5 m -81.38 72.19 8.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.569 -0.742 . . . . 0.0 109.812 175.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.638 ' H ' ' HB3' ' A' ' 100' ' ' PRO . 0.4 OUTLIER -92.56 -93.84 0.15 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.041 -171.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.427 ' H ' ' HB3' ' A' ' 37' ' ' TYR . . . -156.5 -167.49 2.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.054 -175.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -80.49 61.97 4.38 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.132 -0.556 . . . . 0.0 112.615 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.05 172.59 7.07 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.416 HG23 ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -140.37 134.73 31.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.14 92.32 3.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.099 0.476 . . . . 0.0 110.684 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -67.04 118.23 10.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.415 ' HA ' HD22 ' A' ' 44' ' ' LEU . 94.0 mt -108.42 118.46 36.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.767 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.3 mtt180 -82.26 89.57 6.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.784 177.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.31 148.13 6.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.795 -173.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.547 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 11.1 mttt -130.18 103.71 6.89 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.988 176.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.24 145.84 25.14 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.086 0.47 . . . . 0.0 111.701 -174.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.48 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -96.54 160.9 28.46 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.864 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.48 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 27.4 Cg_endo -63.88 0.81 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.035 2.49 . . . . 0.0 113.319 -178.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -104.12 -2.39 25.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.014 0.435 . . . . 0.0 110.555 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.477 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 97.31 -23.66 34.83 Favored Glycine 0 C--O 1.226 -0.354 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.585 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.9 ptm -73.31 148.98 43.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.746 0.308 . . . . 0.0 110.446 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.46 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -85.8 124.79 32.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.808 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.88 -14.7 33.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.167 0.508 . . . . 0.0 109.947 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 42.4 t0 -160.44 140.08 11.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.919 178.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 5.7 tt -159.25 113.32 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 120.971 0.415 . . . . 0.0 110.321 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.46 142.08 25.18 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.725 -178.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.512 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 14.7 Cg_exo -69.72 128.98 16.84 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.456 ' HB3' ' HB ' ' A' ' 43' ' ' THR . 22.8 tt0 -83.19 -57.91 3.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.575 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -156.07 144.46 10.9 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.58 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 158.53 -133.42 3.43 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.384 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -113.52 125.32 29.76 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.84 -43.88 52.74 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.98 2.454 . . . . 0.0 112.82 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.81 -52.01 42.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.126 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.45 ' HA ' HD11 ' A' ' 66' ' ' LEU . 23.1 tp -57.43 -47.3 82.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.968 0.413 . . . . 0.0 110.97 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.608 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.2 m -63.61 -42.71 98.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.06 -178.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.15 -41.01 99.19 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.814 0.34 . . . . 0.0 110.819 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.33 91.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.564 177.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.53 -37.6 81.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.113 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 24.9 mt -59.82 -50.14 74.96 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.587 178.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.13 97.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.168 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.38 81.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.212 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.75 -27.78 69.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.292 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt -69.32 -34.6 74.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.626 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.45 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -85.95 -28.49 24.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -178.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 126.94 31.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.1 mtpt -94.85 107.27 19.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.876 -177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.703 HD11 HG12 ' A' ' 23' ' ' ILE . 6.9 mm -81.42 128.22 70.71 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.062 177.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -64.93 132.35 31.98 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.747 2.298 . . . . 0.0 111.01 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.478 ' HB3' ' HE2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -53.11 128.04 47.54 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.011 -177.094 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.432 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 20.4 Cg_endo -64.49 121.32 8.87 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.782 2.321 . . . . 0.0 112.001 -176.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 6.6 Cg_endo -83.91 -69.06 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.926 2.417 . . . . 0.0 112.53 -176.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.22 134.07 55.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.233 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.405 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 2.1 mt-30 -55.12 -40.42 70.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.726 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.46 -50.97 71.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.951 0.405 . . . . 0.0 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.1 -42.02 95.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.973 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.432 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -65.26 -36.01 82.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.395 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 19.8 mm-40 -76.48 -40.29 50.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.0 110.549 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.2 t -64.33 -46.03 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.177 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -76.99 -6.19 51.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.667 -177.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 8.2 mttt -61.32 -23.72 65.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.023 0.44 . . . . 0.0 110.258 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.462 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.7 OUTLIER -158.11 74.82 0.73 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.968 174.266 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -116.86 81.95 12.63 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.084 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.767 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.7 Cg_exo -73.41 104.83 1.87 Allowed 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.751 2.3 . . . . 0.0 111.192 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.6 146.34 23.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.204 -174.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -79.18 94.15 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.943 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.605 ' HZ ' HG22 ' A' ' 23' ' ' ILE . 1.1 m-85 -86.14 103.2 14.57 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.628 0.727 . . . . 0.0 110.894 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.416 ' HB3' HG23 ' A' ' 41' ' ' THR . 3.3 ptmt -109.92 158.21 35.6 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.46 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.638 ' HB3' ' H ' ' A' ' 37' ' ' TYR . 79.0 Cg_exo -53.5 97.66 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.685 2.257 . . . . 0.0 111.582 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.425 ' CE1' HG22 ' A' ' 27' ' ' ILE . 3.7 p-80 -89.29 129.86 35.78 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.521 -170.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 8.7 p-80 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.07 -0.967 . . . . 0.0 109.539 175.378 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.113 0 CA-C-O 120.701 0.286 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -109.91 148.58 31.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.763 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.408 ' HB3' ' H ' ' A' ' 4' ' ' GLY . 0.2 OUTLIER -110.14 -103.36 0.38 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.101 0.477 . . . . 0.0 111.421 -178.111 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.408 ' H ' ' HB3' ' A' ' 3' ' ' PHE . . . 124.16 94.53 1.08 Allowed Glycine 0 N--CA 1.444 -0.788 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -174.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -83.4 -52.91 6.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.743 0.306 . . . . 0.0 111.611 -171.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.84 91.68 5.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.65 -176.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.08 151.67 4.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.111 177.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -91.34 129.67 37.3 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 177.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.14 115.61 6.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.561 -177.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 146.49 121.83 1.36 Allowed Glycine 0 N--CA 1.443 -0.84 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.956 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.37 -29.68 62.79 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -109.34 174.88 5.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.505 172.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.92 90.61 0.98 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.639 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.3 -38.6 85.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.01 0.434 . . . . 0.0 109.976 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.6 -38.24 90.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.027 176.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.6 mm -61.02 -43.46 96.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.65 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -44.07 95.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.099 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.427 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 4.5 t-20 -68.45 -32.89 73.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.09 -48.19 45.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.739 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.2 -49.05 78.41 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.162 -179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -61.7 -43.02 99.81 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.344 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -60.87 -32.52 71.95 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.655 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 52.6 mt -67.68 -42.41 86.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.852 0.358 . . . . 0.0 110.362 178.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.518 ' HB3' ' CE1' ' A' ' 101' ' ' HIS . 0.6 OUTLIER -64.81 -40.3 95.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.716 176.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.575 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 12.4 m -64.8 -41.98 95.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.97 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.478 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -56.37 -50.42 71.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.612 HG22 ' HB2' ' A' ' 73' ' ' ALA . 50.5 mt -63.46 -43.85 98.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.5 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.575 ' OE1' ' HA ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -65.61 -26.38 67.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.792 0.33 . . . . 0.0 111.069 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.3 m -76.44 -1.93 29.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.752 0.31 . . . . 0.0 111.093 177.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 6.2 mmtt -115.17 2.14 14.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 0.0 110.636 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.592 ' HB3' ' O ' ' A' ' 33' ' ' ASP . 0.0 OUTLIER -82.32 136.27 35.05 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.559 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -54.61 -60.16 3.73 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.244 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.629 ' HB3' ' HA ' ' A' ' 36' ' ' SER . 5.0 t70 -89.16 149.48 23.13 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 106.085 -1.821 . . . . 0.0 106.085 164.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -46.64 -52.77 12.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 118.241 0.473 . . . . 0.0 110.482 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.73 ' HB3' ' HB2' ' A' ' 102' ' ' HIS . 0.2 OUTLIER -83.18 -44.15 15.36 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.992 172.092 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.629 ' HA ' ' HB3' ' A' ' 33' ' ' ASP . 38.2 m 71.36 -46.27 0.64 Allowed 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.775 0.83 . . . . 0.0 111.67 -173.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -129.43 -176.81 4.01 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -174.41 155.59 2.34 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.579 0.549 . . . . 0.0 110.093 177.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.1 18.43 72.07 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.761 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.29 158.07 43.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.737 0.303 . . . . 0.0 110.439 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.544 HG23 ' HG3' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -122.66 162.14 22.5 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.208 177.633 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.652 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 43.2 t -146.79 142.01 27.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.548 -178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.98 104.27 7.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.517 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.42 125.48 51.03 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.913 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.941 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.4 OUTLIER -74.05 127.81 33.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 173.976 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.482 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.1 pt -129.26 142.3 44.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.073 0.464 . . . . 0.0 110.217 -178.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.47 ' HB2' ' CB ' ' A' ' 56' ' ' ASP . 7.7 mtpt -133.02 115.29 14.98 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.1 mt -79.9 130.2 35.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.129 0.49 . . . . 0.0 111.574 -173.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.466 ' HB3' HD22 ' A' ' 55' ' ' LEU . . . -90.34 158.61 43.25 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.9 176.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -59.75 -13.61 22.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.965 2.444 . . . . 0.0 113.361 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -98.79 -6.41 29.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.374 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.444 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 110.88 -19.8 25.08 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.29 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.36 158.66 27.39 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.921 0.36 . . . . 0.0 111.059 -178.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -88.98 106.94 18.75 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 175.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.466 HD22 ' HB3' ' A' ' 49' ' ' ALA . 1.3 pp -72.82 -31.88 65.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.304 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.482 ' O ' ' HA ' ' A' ' 46' ' ' ILE . 0.4 OUTLIER -118.74 124.8 48.17 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.718 176.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.1 tp -148.56 106.72 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.246 0.546 . . . . 0.0 109.648 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -147.86 128.45 6.89 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.96 -172.787 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.652 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 12.6 Cg_exo -70.26 92.7 0.56 Allowed 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.098 2.532 . . . . 0.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.33 -45.8 75.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.484 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -141.82 -179.12 18.61 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.504 -0.638 . . . . 0.0 111.504 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.652 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 102.32 -178.15 26.45 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.64 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.95 121.92 83.3 Favored Pre-proline 0 C--N 1.327 -0.399 0 C-N-CA 122.415 0.286 . . . . 0.0 110.49 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.82 -43.48 54.15 Favored 'Trans proline' 0 CA--C 1.528 0.216 0 C-N-CA 122.79 2.327 . . . . 0.0 112.74 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.19 -38.95 92.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.853 0.359 . . . . 0.0 111.17 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.415 HD23 ' HD3' ' A' ' 100' ' ' PRO . 37.1 tp -71.49 -45.98 61.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 178.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.652 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 68.8 m -65.92 -38.99 90.15 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.703 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -64.55 -37.23 86.82 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.819 0.342 . . . . 0.0 110.455 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.07 -37.22 72.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.384 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.99 -27.91 69.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.004 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.496 ' HA ' HD23 ' A' ' 71' ' ' LEU . 25.5 mt -61.1 -45.31 95.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 110.365 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.25 86.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.621 178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.612 ' HB2' HG22 ' A' ' 27' ' ' ILE . . . -64.45 -44.14 92.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.341 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.99 70.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -74.83 -25.98 59.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.339 177.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.0 -13.43 50.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.316 0.579 . . . . 0.0 110.296 177.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -86.28 149.23 25.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.096 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -125.86 91.37 3.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.851 0.357 . . . . 0.0 110.075 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.54 HG21 ' HD2' ' A' ' 80' ' ' PRO . 29.2 mm -66.24 127.84 93.49 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.656 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.54 ' HD2' HG21 ' A' ' 79' ' ' ILE . 30.9 Cg_endo -67.48 153.64 76.0 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.57 2.18 . . . . 0.0 112.263 -175.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.23 122.14 73.7 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.925 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.402 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 50.3 Cg_exo -41.34 118.45 0.77 Allowed 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 123.835 3.023 . . . . 0.0 113.879 -174.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 3.1 Cg_endo -79.38 -75.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 123.109 2.539 . . . . 0.0 111.38 177.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.8 124.98 27.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.895 175.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -64.01 -26.97 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.58 0.229 . . . . 0.0 111.021 -177.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.02 -25.9 68.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.204 0.526 . . . . 0.0 110.969 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -30.65 16.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.795 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -78.6 -38.0 41.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.271 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.43 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 25.7 pt-20 -67.76 -18.67 64.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.87 0.367 . . . . 0.0 110.877 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -92.07 -49.54 13.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.681 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -87.81 26.24 1.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -177.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.43 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.1 ttmt -73.08 -31.07 64.13 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.082 0.468 . . . . 0.0 110.27 177.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.448 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 12.5 p-10 -151.87 38.47 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.106 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -102.85 103.63 34.46 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 177.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.941 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.9 Cg_exo -72.25 155.11 56.53 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.886 2.391 . . . . 0.0 112.037 -174.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -99.19 132.44 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.294 -172.665 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -92.19 120.07 32.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.98 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -117.02 142.49 46.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.382 0.611 . . . . 0.0 111.723 -172.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.544 ' HG3' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -145.18 143.56 20.79 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.532 174.226 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.415 ' HD3' HD23 ' A' ' 66' ' ' LEU . 60.6 Cg_exo -53.55 107.38 0.2 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.665 2.243 . . . . 0.0 111.737 -178.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.518 ' CE1' ' HB3' ' A' ' 24' ' ' LYS . 1.2 m170 -68.2 95.67 0.59 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.459 0.647 . . . . 0.0 111.748 -173.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.73 ' HB2' ' HB3' ' A' ' 35' ' ' SER . 16.0 t-80 . . . . . 0 C--O 1.251 1.169 0 CA-C-O 117.867 -1.063 . . . . 0.0 109.014 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.067 0 CA-C-O 120.733 0.301 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.701 ' HG2' ' H ' ' A' ' 4' ' ' GLY . 0.0 OUTLIER -92.16 -27.96 17.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.839 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 66.48 22.65 10.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.762 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.701 ' H ' ' HG2' ' A' ' 2' ' ' GLU . . . 43.99 -109.28 0.24 Allowed Glycine 0 C--N 1.337 0.63 0 O-C-N 123.882 0.739 . . . . 0.0 113.218 177.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -109.18 102.49 11.44 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.42 -2.13 36.9 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.559 -178.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.502 ' O ' ' HB3' ' A' ' 8' ' ' ASN . 18.6 mtmt -79.29 122.25 26.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.546 175.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.502 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 3.4 t30 74.81 100.68 0.07 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.775 0.798 . . . . 0.0 110.053 -174.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -137.76 21.94 2.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.737 -177.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.62 58.74 4.71 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.382 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.93 124.89 52.85 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.367 -0.234 . . . . 0.0 110.367 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.457 ' HB2' ' H ' ' A' ' 13' ' ' GLY . 0.7 OUTLIER 54.94 -95.47 0.05 Allowed 'General case' 0 CA--C 1.538 0.484 0 O-C-N 123.979 0.799 . . . . 0.0 111.85 -179.538 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.457 ' H ' ' HB2' ' A' ' 12' ' ' SER . . . -148.19 59.55 0.46 Allowed Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.43 ' HA ' ' HB3' ' A' ' 17' ' ' ASN . . . -70.78 -11.07 60.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.474 0.178 . . . . 0.0 111.386 -178.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -75.4 -41.16 56.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.983 0.421 . . . . 0.0 110.124 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.446 ' HA ' HG21 ' A' ' 87' ' ' VAL . 1.7 mt -71.64 -39.62 69.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.056 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.43 ' HB3' ' HA ' ' A' ' 14' ' ' ALA . 1.5 t-20 -66.17 -32.02 73.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.681 178.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -62.17 -43.84 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 177.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 23' ' ' ILE . 11.3 t80 -62.54 -48.36 79.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 177.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.63 -45.64 85.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 111.293 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.36 -35.9 90.87 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.489 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -66.97 -38.96 87.03 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.465 0.172 . . . . 0.0 111.465 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.618 HG12 HG21 ' A' ' 79' ' ' ILE . 14.1 mt -63.17 -43.14 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.436 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -62.81 -40.19 96.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.722 177.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.2 m -70.26 -34.24 72.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.924 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.09 -40.57 94.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.007 0.432 . . . . 0.0 110.752 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.592 HG23 ' HB2' ' A' ' 73' ' ' ALA . 37.7 mt -66.18 -37.91 80.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.641 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.571 ' HG2' ' H ' ' A' ' 33' ' ' ASP . 1.4 tm-20 -72.98 -20.79 60.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.905 176.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -74.24 -7.94 54.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.215 0.531 . . . . 0.0 110.7 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.614 ' HD2' ' HB2' ' A' ' 76' ' ' LEU . 2.5 mmtm -114.21 -27.16 7.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.034 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -123.37 85.55 2.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.41 174.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -47.49 90.6 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.989 0.805 . . . . 0.0 112.612 -175.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.571 ' H ' ' HG2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER 53.24 17.64 1.06 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.016 0.926 . . . . 0.0 111.319 -176.544 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.36 -56.16 4.24 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.506 -177.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.914 ' HB2' ' HZ ' ' A' ' 98' ' ' PHE . 1.2 p -69.9 -27.75 65.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.567 0.699 . . . . 0.0 109.93 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.3 m -80.54 82.68 6.5 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.575 177.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.462 ' HB3' ' H ' ' A' ' 38' ' ' ALA . 0.1 OUTLIER -81.76 -117.78 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.392 -178.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.462 ' H ' ' HB3' ' A' ' 37' ' ' TYR . . . -172.68 147.36 1.77 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.514 0.197 . . . . 0.0 110.983 177.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.18 -52.46 4.64 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.358 -0.449 . . . . 0.0 113.128 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -80.13 151.53 29.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.774 0.321 . . . . 0.0 111.559 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.87 153.12 50.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.103 176.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 117.32 12.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.879 0.371 . . . . 0.0 110.959 -178.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 m -84.9 104.8 15.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.789 0.328 . . . . 0.0 110.465 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.0 mt -93.49 114.0 26.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.239 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.617 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.6 ttm180 -74.52 96.16 2.89 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.2 pt -117.59 113.78 43.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.382 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.687 ' HG2' HD21 ' A' ' 55' ' ' LEU . 3.2 tttt -97.91 111.72 23.92 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.511 HD12 ' HD2' ' A' ' 91' ' ' PHE . 2.2 mt -94.8 124.86 39.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.0 0.428 . . . . 0.0 110.888 -174.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.61 152.92 95.23 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.011 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.08 -20.17 44.57 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.177 2.584 . . . . 0.0 113.472 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -83.82 -4.03 58.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.699 0.285 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.81 44.45 4.83 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.608 176.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.433 ' O ' ' HG3' ' A' ' 53' ' ' MET . 0.0 OUTLIER -139.39 142.39 37.53 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 177.221 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.83 96.83 7.12 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.777 0.322 . . . . 0.0 110.151 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.687 HD21 ' HG2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -73.01 -35.17 66.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.023 0.44 . . . . 0.0 110.14 -178.71 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.43 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 34.3 t0 -126.62 101.84 6.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.217 177.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 tt -127.99 111.36 24.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.06 0.457 . . . . 0.0 110.294 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -153.79 141.8 13.94 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 -177.821 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 20.6 Cg_exo -64.8 124.68 13.52 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.459 2.106 . . . . 0.0 111.865 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.15 -54.57 4.93 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -162.07 144.61 9.87 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 177.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 157.32 -130.03 2.53 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.501 -178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.6 121.59 25.79 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.551 0.215 . . . . 0.0 110.56 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -46.72 -45.0 20.98 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 123.596 2.864 . . . . 0.0 113.431 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.59 -52.11 65.75 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.716 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.452 ' HG ' ' CE2' ' A' ' 98' ' ' PHE . 9.2 tp -66.22 -42.64 88.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 4.0 m -63.51 -42.19 98.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.595 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -65.87 -39.8 91.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.07 91.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.291 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 74' ' ' ALA . . . -67.32 -46.31 73.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.723 176.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 71' ' ' LEU . 1.4 mt -55.06 -46.09 75.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.012 0.434 . . . . 0.0 111.026 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.85 88.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.728 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.592 ' HB2' HG23 ' A' ' 27' ' ' ILE . . . -81.98 -41.57 20.58 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -176.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 70' ' ' ALA . . . -60.67 -32.96 72.14 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.63 61.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.169 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.614 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 1.9 mt -90.62 -25.43 20.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 110.566 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.44 138.64 58.52 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.636 -174.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 81.1 2.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.331 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.618 HG21 HG12 ' A' ' 23' ' ' ILE . 2.3 mp -71.44 126.17 91.76 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.552 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.7 Cg_exo -66.8 177.66 3.34 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 123.08 2.52 . . . . 0.0 112.007 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 142.92 31.09 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.271 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.416 ' HG3' ' CZ ' ' A' ' 91' ' ' PHE . 6.5 Cg_endo -48.68 118.27 3.28 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.401 2.734 . . . . 0.0 112.223 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.57 -29.01 70.12 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.089 2.526 . . . . 0.0 113.313 -175.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.22 159.48 40.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.853 0.358 . . . . 0.0 111.278 -177.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -62.76 -34.75 77.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.12 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.19 -37.9 81.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.446 HG21 ' HA ' ' A' ' 16' ' ' ILE . 2.2 t -74.63 -26.87 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.866 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.479 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.3 OUTLIER -61.59 -37.94 85.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.498 178.23 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -72.44 -35.33 68.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.556 ' O ' ' HB1' ' A' ' 94' ' ' ALA . 84.2 t -70.38 -54.54 18.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.579 -177.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.511 ' HD2' HD12 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -71.01 9.23 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -174.628 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.479 ' HD2' ' O ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -75.04 -25.4 58.68 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.111 -0.368 . . . . 0.0 111.227 177.444 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -173.74 34.64 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.667 0.27 . . . . 0.0 111.628 -177.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.556 ' HB1' ' O ' ' A' ' 90' ' ' VAL . . . -102.54 113.05 66.08 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 120.823 0.344 . . . . 0.0 110.691 176.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.617 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 20.1 Cg_exo -72.83 144.72 39.41 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.052 2.501 . . . . 0.0 111.542 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.506 ' HA ' HD22 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -91.69 142.87 27.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -174.869 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.83 97.19 9.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.454 173.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.914 ' HZ ' ' HB2' ' A' ' 35' ' ' SER . 57.6 t80 -79.3 107.4 12.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.454 0.645 . . . . 0.0 110.596 -177.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.587 ' HG2' ' HD2' ' A' ' 100' ' ' PRO . 5.3 ttpt -150.03 148.89 26.09 Favored Pre-proline 0 C--N 1.311 -1.086 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.587 ' HD2' ' HG2' ' A' ' 99' ' ' LYS . 23.8 Cg_exo -31.61 119.64 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 124.202 3.268 . . . . 0.0 112.564 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 102' ' ' HIS . 2.5 p80 -45.19 138.56 3.86 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.121 -0.945 . . . . 0.0 113.219 -168.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 101' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.278 0 CA-C-N 113.994 -1.457 . . . . 0.0 110.062 -174.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.909 0 CA-C-O 120.284 0.087 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.62 94.14 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.977 0.798 . . . . 0.0 111.786 178.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -146.6 -173.78 4.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.992 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.35 7.97 69.15 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.294 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.9 t30 65.57 22.11 11.74 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.122 0.487 . . . . 0.0 110.808 -179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.07 51.8 2.03 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.303 0.573 . . . . 0.0 111.016 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.93 57.86 1.33 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.034 179.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -138.99 144.84 39.09 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.377 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -159.54 144.11 15.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.119 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.26 -176.02 38.36 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.478 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -104.43 -44.17 4.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.171 0.51 . . . . 0.0 109.944 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 m -80.88 145.41 31.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.225 172.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 114.78 -21.27 14.12 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.076 -173.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.44 -23.69 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 174.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -46.53 76.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.575 174.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.0 mt -64.01 -43.15 97.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.403 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -60.48 -33.21 72.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.862 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 17.4 t-20 -74.69 -47.77 29.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.687 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -68.27 -37.73 81.01 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.205 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.94 -27.19 64.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.432 0.634 . . . . 0.0 109.459 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.73 -27.86 73.57 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.052 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 18' ' ' ASN . 50.8 mm-40 -63.4 -33.31 75.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.049 0.452 . . . . 0.0 109.966 176.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.8 mm -77.26 -42.27 30.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.656 176.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.454 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 4.7 mtpm? -58.88 -53.85 53.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.338 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -59.75 -33.08 71.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.657 0.265 . . . . 0.0 111.292 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.3 -50.13 71.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.566 HG22 ' HE2' ' A' ' 101' ' ' HIS . 74.7 mt -68.3 -32.62 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.206 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.443 ' HG3' ' CD2' ' A' ' 101' ' ' HIS . 0.0 OUTLIER -65.55 -20.66 66.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.951 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.44 14.86 28.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 177.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.423 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -148.89 33.3 0.76 Allowed 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.14 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.407 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 14.3 p90 -70.17 -29.4 66.28 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 113.756 -1.566 . . . . 0.0 112.676 -167.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 1.7 m-85 71.1 -72.24 0.12 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -169.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -149.84 24.94 0.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.708 0.766 . . . . 0.0 109.905 168.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.476 ' O ' ' HA ' ' A' ' 100' ' ' PRO . . . -73.8 -29.83 62.39 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.073 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.866 ' HA ' ' HB2' ' A' ' 101' ' ' HIS . 73.6 m -77.56 -17.69 57.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.188 0.518 . . . . 0.0 110.731 -178.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m -109.46 -73.27 0.69 Allowed 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.06 -177.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.464 ' HB3' ' H ' ' A' ' 38' ' ' ALA . 0.2 OUTLIER 37.23 -107.57 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.891 0.877 . . . . 0.0 112.618 -179.579 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.5 ' HB3' ' H ' ' A' ' 39' ' ' GLY . . . -154.56 -119.32 0.03 OUTLIER 'General case' 0 C--O 1.227 -0.129 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.5 ' H ' ' HB3' ' A' ' 38' ' ' ALA . . . -130.5 36.41 2.3 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.426 -176.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.526 ' O ' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -88.56 176.92 6.93 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.537 0.208 . . . . 0.0 110.572 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.42 ' HA ' ' HB3' ' A' ' 99' ' ' LYS . 23.7 m -153.95 115.83 4.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.535 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.5 OUTLIER -121.16 177.97 4.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.147 -178.571 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.8 m -148.89 122.24 9.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.202 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.8 mt -94.23 113.55 25.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.569 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.69 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 tmm_? -78.15 89.44 4.25 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 175.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -102.37 136.67 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.051 -173.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.574 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -114.63 100.15 8.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.319 177.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 tp -86.34 126.41 34.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.202 -174.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -76.92 167.74 34.12 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.246 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.539 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 6.7 Cg_endo -52.66 -37.96 75.71 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.162 2.575 . . . . 0.0 113.657 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -74.01 -10.7 59.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.948 0.404 . . . . 0.0 111.406 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 97.73 11.58 50.03 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.032 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ptm -98.94 146.71 25.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.422 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -77.48 109.59 11.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.77 0.319 . . . . 0.0 110.306 -179.09 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.61 -21.23 30.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.374 0.607 . . . . 0.0 109.893 178.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.574 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 48.1 t0 -149.3 135.55 19.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.106 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.7 tt -153.89 113.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.221 0.534 . . . . 0.0 110.372 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.6 tttp -151.85 132.61 7.54 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.084 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.535 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 50.8 Cg_exo -55.44 125.41 19.05 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.713 2.275 . . . . 0.0 112.214 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -77.31 -53.53 7.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.965 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -174.39 151.76 13.3 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.038 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.535 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 149.88 -101.67 0.22 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.808 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.555 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 12.6 t70 -141.42 129.44 12.06 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 -178.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -56.33 -40.65 83.3 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.362 2.708 . . . . 0.0 113.432 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.07 -38.3 63.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.928 0.394 . . . . 0.0 110.984 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -66.58 -50.21 63.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.551 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.647 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.3 m -69.45 -21.91 63.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.509 -177.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -67.74 -50.55 56.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.15 -31.47 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.377 177.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 98' ' ' PHE . . . -56.44 -46.19 80.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.45 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 6.4 mt -62.69 -41.31 99.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.893 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.04 -44.89 79.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.018 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.498 ' HB3' ' CG2' ' A' ' 27' ' ' ILE . . . -64.91 -43.01 94.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.03 -24.56 66.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 0.0 110.952 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 -28.49 46.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.565 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.423 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -86.99 -20.14 27.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.884 -178.074 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -92.59 149.75 21.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.498 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 pttp -105.73 135.41 47.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.422 0.63 . . . . 0.0 111.051 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.5 mp -110.09 130.84 22.4 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.288 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -84.67 164.47 12.2 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.143 1.895 . . . . 0.0 112.21 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 ttmm -70.88 126.87 92.19 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.933 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.456 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 52.4 Cg_exo -54.66 117.73 4.31 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.947 2.432 . . . . 0.0 112.048 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -70.31 -62.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.571 2.181 . . . . 0.0 112.832 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.65 138.81 32.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.748 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.514 ' HA ' ' HB3' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -61.05 -30.79 70.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 0.0 111.046 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.09 -52.76 63.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 177.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -69.12 -35.51 68.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.046 0.45 . . . . 0.0 110.404 178.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.514 ' HB3' ' HA ' ' A' ' 85' ' ' GLN . 0.9 OUTLIER -56.39 -43.87 79.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.873 179.682 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 33.7 mt-10 -75.61 -35.01 60.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.171 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.3 t -64.98 -43.16 96.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.106 0.479 . . . . 0.0 109.885 178.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -83.69 41.83 0.81 Allowed 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.077 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 1.1 tpmp? -101.82 -23.98 14.11 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.121 0.486 . . . . 0.0 109.738 175.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -158.98 59.89 0.42 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.052 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.12 95.78 49.16 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.595 -176.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.69 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.1 Cg_exo -72.96 137.72 27.18 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 123.012 2.474 . . . . 0.0 111.511 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.38 153.66 17.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.77 133.49 40.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.191 173.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 70' ' ' ALA . 0.7 OUTLIER -131.82 103.06 6.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.519 0.676 . . . . 0.0 111.25 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.623 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.3 OUTLIER -139.95 167.6 17.78 Favored Pre-proline 0 C--N 1.315 -0.912 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.389 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.623 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 9.5 Cg_endo -45.45 107.03 0.1 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.059 2.506 . . . . 0.0 110.626 175.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.866 ' HB2' ' HA ' ' A' ' 35' ' ' SER . 4.2 m-70 -62.5 130.62 45.98 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 113.99 -1.459 . . . . 0.0 113.298 -163.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.954 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.196 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.777 0.322 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -127.19 -83.27 0.61 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.327 -179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 62.74 15.04 7.78 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.627 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 68.37 5.25 41.82 Favored Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 116.258 -0.428 . . . . 0.0 113.303 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.97 -47.33 0.66 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.614 0.766 . . . . 0.0 111.556 -177.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.43 -1.0 57.3 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.567 0.222 . . . . 0.0 111.306 -178.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp 71.46 -63.05 0.44 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.666 0.786 . . . . 0.0 111.235 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -154.67 -52.11 0.09 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.0 t30 67.15 -67.95 0.16 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.436 0.695 . . . . 0.0 112.171 176.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.89 64.59 3.2 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.392 -0.683 . . . . 0.0 111.392 -177.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.72 105.18 12.12 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.857 0.36 . . . . 0.0 111.179 -176.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.12 -20.89 18.28 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.04 0.448 . . . . 0.0 109.931 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 66.07 48.61 63.87 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.278 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.84 68.82 0.66 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.45 0.643 . . . . 0.0 110.739 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -167.22 -49.08 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.225 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.753 ' HA ' HG21 ' A' ' 87' ' ' VAL . 0.7 OUTLIER -87.05 -40.69 14.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.835 176.179 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -60.5 -26.73 67.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.864 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.32 -52.53 53.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.654 0.264 . . . . 0.0 110.56 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.583 178.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.532 ' HA ' HD11 ' A' ' 23' ' ' ILE . . . -64.28 -39.85 94.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.233 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.52 -33.46 87.31 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.733 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.89 -38.77 86.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.587 0.232 . . . . 0.0 111.214 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.532 HD11 ' HA ' ' A' ' 20' ' ' ALA . 5.8 mt -62.51 -36.03 72.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.003 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.513 ' HB3' ' NE2' ' A' ' 101' ' ' HIS . 3.6 mmtp -58.46 -50.18 74.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.147 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.51 -32.74 58.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.539 -178.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.89 -47.94 83.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.14 0.495 . . . . 0.0 111.212 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.469 HD13 HG23 ' A' ' 23' ' ' ILE . 84.1 mt -73.92 -31.39 30.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.804 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -29.38 70.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.912 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.97 -8.54 59.0 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.987 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.49 36.34 4.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.79 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.544 ' HB2' ' H ' ' A' ' 35' ' ' SER . 14.0 p90 -72.53 123.53 23.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.482 0.658 . . . . 0.0 110.956 -178.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.476 ' HB3' ' H ' ' A' ' 33' ' ' ASP . 0.9 OUTLIER -74.43 -77.08 0.12 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 174.43 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 32' ' ' TYR . 0.5 OUTLIER -128.7 26.33 5.6 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.455 -1.702 . . . . 0.0 107.101 166.374 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.96 -56.29 7.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 113.841 -1.527 . . . . 0.0 111.283 -173.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.544 ' H ' ' HB2' ' A' ' 31' ' ' PHE . 16.3 m -69.23 -16.73 63.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.163 0.506 . . . . 0.0 110.679 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 m -97.0 -11.94 23.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.764 -172.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -83.15 43.48 0.87 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -174.855 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.8 67.38 0.1 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.473 0.654 . . . . 0.0 112.471 -175.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -172.39 1.04 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.674 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.149 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mmtp -138.64 163.56 31.76 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.849 0.357 . . . . 0.0 111.196 -177.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.39 162.37 22.9 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.205 175.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.71 107.1 1.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.695 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.2 m -87.59 135.01 33.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.786 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 70' ' ' ALA . 0.1 OUTLIER -127.0 126.73 43.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.82 0.343 . . . . 0.0 110.692 -179.033 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.802 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 2.7 ttm-85 -80.61 97.92 7.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.715 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.6 pt -105.91 149.07 9.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.33 0.586 . . . . 0.0 111.528 -175.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.558 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 22.1 mttp -127.1 109.4 11.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.932 177.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -95.39 150.14 20.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.395 0.617 . . . . 0.0 111.694 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -111.58 161.06 27.14 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.366 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.05 -17.07 43.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.23 2.62 . . . . 0.0 113.169 -178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.9 0.43 51.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.791 0.329 . . . . 0.0 111.125 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.62 29.54 52.02 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.869 177.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -132.88 143.98 49.87 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.494 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -89.49 112.48 23.66 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.846 0.355 . . . . 0.0 110.352 -178.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -30.87 62.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.224 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.558 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.8 t70 -133.32 139.52 46.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.176 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.487 HG12 HD21 ' A' ' 71' ' ' LEU . 5.6 tt -155.78 106.78 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.293 0.568 . . . . 0.0 109.652 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.03 133.75 24.89 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.133 -172.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -60.47 125.52 17.59 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.461 2.107 . . . . 0.0 111.613 177.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' ' 45' ' ' ARG . 9.4 mm-40 -87.66 -68.57 0.75 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.703 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.75 133.74 4.31 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.272 -0.877 . . . . 0.0 111.291 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 154.45 -159.16 28.71 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.176 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -78.18 125.87 84.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.469 0.176 . . . . 0.0 110.76 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 53.3 Cg_exo -53.6 -37.32 83.09 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.923 2.415 . . . . 0.0 112.82 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.09 -43.58 42.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.213 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -65.99 -47.09 75.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.884 0.373 . . . . 0.0 110.388 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.572 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.3 m -62.58 -44.63 95.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.506 ' HA ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -61.16 -41.51 96.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.907 178.401 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.53 -31.56 72.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.022 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.469 ' HB3' HD12 ' A' ' 44' ' ' LEU . . . -69.83 -44.93 68.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 0.1 OUTLIER -62.31 -41.92 98.94 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.836 0.35 . . . . 0.0 110.576 178.696 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -46.57 87.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.957 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.15 -43.43 91.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.545 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.36 75.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.36 -26.08 55.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.712 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.05 -33.14 33.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.409 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.93 166.95 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.028 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.22 115.39 26.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.1 178.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.487 HD11 HG22 ' A' ' 23' ' ' ILE . 28.5 mm -87.31 125.63 65.14 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.959 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.55 124.86 17.28 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.414 2.076 . . . . 0.0 111.715 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.44 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -55.86 145.48 52.57 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.665 -178.386 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.458 ' HG3' ' HZ ' ' A' ' 91' ' ' PHE . 12.4 Cg_exo -34.64 99.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 125.129 3.886 . . . . 0.0 114.774 -175.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -79.07 -37.52 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.529 2.153 . . . . 0.0 111.251 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -99.42 146.69 26.05 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.012 177.235 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -76.83 -40.08 49.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 111.074 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.9 -27.59 64.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.924 0.393 . . . . 0.0 111.249 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.753 HG21 ' HA ' ' A' ' 16' ' ' ILE . 0.5 OUTLIER -71.0 -23.7 23.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.618 -178.208 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.51 ' HA ' ' CZ ' ' A' ' 91' ' ' PHE . 89.6 t80 -65.4 -34.03 77.35 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.103 0.477 . . . . 0.0 110.467 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.53 -18.35 60.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.563 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 52.5 t -85.93 -53.4 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.938 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.51 ' CZ ' ' HA ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -81.25 9.87 6.36 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -173.182 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -61.61 -30.18 70.52 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.557 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 10.8 t30 -160.09 72.53 0.5 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.529 -1.214 . . . . 0.0 108.643 171.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 90' ' ' VAL . . . -113.17 84.58 7.38 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.943 -175.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.802 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 21.2 Cg_exo -73.46 110.78 3.14 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.065 2.51 . . . . 0.0 111.71 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.63 151.7 19.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.823 -175.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.695 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 29.2 t70 -103.76 100.94 10.77 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 176.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.53 135.06 33.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.227 0.536 . . . . 0.0 111.251 -176.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.26 144.01 49.17 Favored Pre-proline 0 C--N 1.323 -0.584 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.701 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.577 ' HG2' ' O ' ' A' ' 37' ' ' TYR . 91.4 Cg_exo -46.03 100.07 0.04 OUTLIER 'Trans proline' 0 N--CA 1.475 0.419 0 C-N-CA 124.061 3.174 . . . . 0.0 112.061 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.513 ' NE2' ' HB3' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -63.14 135.25 57.06 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -167.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 . . . . . 0 C--N 1.317 -0.808 0 CA-C-N 113.785 -1.552 . . . . 0.0 107.637 169.728 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 120.937 0.398 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -143.64 96.93 2.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.596 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -100.56 86.76 3.21 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.932 0.396 . . . . 0.0 111.276 -175.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.66 76.83 2.06 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 174.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -59.81 116.24 3.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.732 0.301 . . . . 0.0 111.289 -174.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -51.91 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.132 -178.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.24 152.96 18.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.14 177.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -87.76 130.28 34.9 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 175.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.452 ' HB3' ' H ' ' A' ' 10' ' ' GLY . 4.6 t-20 -83.56 -101.19 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.419 -173.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.452 ' H ' ' HB3' ' A' ' 9' ' ' ASN . . . 79.1 -70.42 2.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.779 -0.725 . . . . 0.0 111.507 -175.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -167.96 -98.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.605 0.362 . . . . 0.0 110.154 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.8 -34.42 30.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.125 0.488 . . . . 0.0 110.717 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 80.12 -60.37 4.47 Favored Glycine 0 CA--C 1.519 0.295 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.962 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.6 -53.11 25.8 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -57.35 -42.96 83.01 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.99 0.424 . . . . 0.0 111.494 -177.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.554 HG23 ' HA ' ' A' ' 87' ' ' VAL . 0.8 OUTLIER -74.01 -42.08 52.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.234 -178.783 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -36.91 85.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.076 0.465 . . . . 0.0 110.554 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -69.91 -37.96 76.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.336 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -42.61 99.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.672 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' A' ' 23' ' ' ILE . . . -66.64 -36.42 82.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 0.0 111.111 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.26 -33.79 56.04 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.815 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -28.29 69.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.693 0.283 . . . . 0.0 111.432 -176.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.469 ' O ' HG13 ' A' ' 27' ' ' ILE . 4.0 mt -70.76 -35.5 60.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.71 0.291 . . . . 0.0 110.485 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -59.87 -47.62 85.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.74 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -35.54 75.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.886 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -47.71 81.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.397 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.581 HG22 ' HB1' ' A' ' 73' ' ' ALA . 53.6 mt -64.59 -36.72 78.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.943 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -64.2 -38.57 91.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 110.962 176.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.1 m -73.15 -10.42 59.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.164 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.706 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.23 -8.79 15.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.2 -178.608 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.598 ' HB3' ' O ' ' A' ' 33' ' ' ASP . 0.2 OUTLIER -66.27 132.29 48.07 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 176.721 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -57.62 -56.99 14.8 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 -175.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.846 ' HB3' ' HA ' ' A' ' 36' ' ' SER . 33.3 t70 -91.35 151.4 20.87 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 165.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -47.27 -58.85 3.64 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.198 0.454 . . . . 0.0 111.282 -172.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.723 ' HB3' ' HB2' ' A' ' 102' ' ' HIS . 0.1 OUTLIER -84.44 -37.57 21.25 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.96 170.68 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.846 ' HA ' ' HB3' ' A' ' 33' ' ' ASP . 49.5 m 74.58 -47.39 0.63 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.096 -173.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.468 ' O ' ' HB2' ' A' ' 35' ' ' SER . 9.5 m-85 -138.23 -165.28 1.77 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 176.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.64 ' HA ' ' HG2' ' A' ' 100' ' ' PRO . . . -173.11 169.28 4.64 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.812 175.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.76 36.28 93.1 Favored Glycine 0 N--CA 1.452 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.869 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.46 151.06 38.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.856 0.36 . . . . 0.0 111.026 -177.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -127.3 128.35 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.642 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.21 105.25 6.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.093 0.473 . . . . 0.0 111.473 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -89.27 118.25 28.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.435 -179.362 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.61 127.37 54.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.36 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.818 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 1.1 tpp180 -80.1 111.89 16.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.9 pt -120.97 137.58 54.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.285 0.564 . . . . 0.0 110.771 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -122.93 111.07 16.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.354 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.6 tp -94.95 143.67 26.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.17 0.51 . . . . 0.0 111.701 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -103.39 166.67 11.37 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.542 177.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -64.17 -11.51 28.04 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.168 1.912 . . . . 0.0 111.782 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.449 ' O ' ' HG3' ' A' ' 81' ' ' LYS . 24.5 t70 -85.52 -13.38 49.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.309 176.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.03 -15.39 63.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.349 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.53 149.16 36.73 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.975 0.417 . . . . 0.0 110.607 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.26 105.55 17.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.887 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.25 -30.63 69.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.561 . . . . 0.0 109.85 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -135.24 131.45 36.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.65 176.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -156.49 105.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.172 0.511 . . . . 0.0 109.656 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.424 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 7.0 ptpp? -154.77 148.18 18.48 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.906 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.648 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 10.4 Cg_exo -73.0 129.61 14.44 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.032 2.488 . . . . 0.0 111.663 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.36 -70.56 0.72 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.9 127.34 6.96 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.674 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 164.45 -138.8 5.47 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.592 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.521 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 11.5 t70 -122.78 129.97 24.81 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 53.6 Cg_exo -55.76 -34.4 90.85 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.131 2.554 . . . . 0.0 113.68 -176.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.77 -43.3 18.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.751 0.31 . . . . 0.0 110.76 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -58.82 -52.25 66.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.569 178.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 11.9 m -63.06 -36.76 84.65 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.846 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -63.53 -43.24 97.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.72 0.295 . . . . 0.0 110.787 177.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.12 99.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.069 0.461 . . . . 0.0 110.221 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.86 95.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.048 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 66.9 mt -57.56 -49.55 76.02 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.835 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.45 -41.62 94.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.168 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.581 ' HB1' HG22 ' A' ' 27' ' ' ILE . . . -71.64 -40.62 69.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.263 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.03 75.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.842 0.353 . . . . 0.0 111.142 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -68.21 -23.85 64.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.176 0.512 . . . . 0.0 110.891 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.706 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -103.54 3.32 34.59 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.57 179.468 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.45 146.28 45.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.182 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.79 86.25 7.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.87 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.3 109.02 62.73 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.926 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -72.1 159.88 48.83 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.983 2.455 . . . . 0.0 112.762 -174.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 51' ' ' ASP . 2.3 ttmt -69.75 117.55 54.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.499 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 81' ' ' LYS . 32.6 Cg_exo -65.48 109.76 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.764 2.31 . . . . 0.0 112.81 -175.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 81' ' ' LYS . 58.4 Cg_endo -82.72 -40.44 0.12 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.468 2.112 . . . . 0.0 111.852 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.3 120.37 20.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.309 177.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -65.12 -31.9 73.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.924 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 90' ' ' VAL . . . -61.18 -36.43 79.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.006 0.432 . . . . 0.0 110.643 176.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.554 ' HA ' HG23 ' A' ' 16' ' ' ILE . 28.6 t -68.48 -48.98 69.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.544 177.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -37.65 83.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 -179.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.9 mm-40 -71.67 -33.08 68.54 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.622 -178.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 86' ' ' ALA . 42.8 t -75.25 -38.0 40.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.193 0.52 . . . . 0.0 110.132 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -79.47 13.7 1.89 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.596 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -70.43 -22.84 62.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.172 175.744 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -161.58 77.84 0.54 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.154 174.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -129.83 80.84 70.6 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.264 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.818 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.4 Cg_exo -73.18 141.24 32.15 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.747 2.298 . . . . 0.0 111.742 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.3 mt -97.96 129.43 44.86 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.291 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.492 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 31.8 t70 -97.85 95.21 7.37 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 172.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -104.32 139.49 39.23 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.492 0.663 . . . . 0.0 112.14 -169.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.38 150.1 48.92 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 114.466 -1.243 . . . . 0.0 107.808 171.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.64 ' HG2' ' HA ' ' A' ' 38' ' ' ALA . 14.5 Cg_endo -57.95 104.28 0.17 Allowed 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 121.915 1.743 . . . . 0.0 110.817 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.432 ' HD1' ' HA ' ' A' ' 101' ' ' HIS . 0.1 OUTLIER -53.38 111.58 0.73 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.766 -1.107 . . . . 0.0 113.493 -166.392 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.723 ' HB2' ' HB3' ' A' ' 35' ' ' SER . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-N 114.343 -1.299 . . . . 0.0 108.905 173.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.662 0.268 . . . . 0.0 110.483 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -71.48 101.62 2.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.217 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.413 ' HD1' ' HA ' ' A' ' 3' ' ' PHE . 1.2 m-30 -88.99 -55.39 3.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.524 -177.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 63.98 -97.73 0.23 Allowed Glycine 0 C--N 1.332 0.327 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -177.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -151.66 -128.33 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 173.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.428 ' HB ' ' H ' ' A' ' 7' ' ' LYS . 0.2 OUTLIER 53.91 -97.42 0.07 Allowed 'General case' 0 C--O 1.237 0.417 0 C-N-CA 122.962 0.505 . . . . 0.0 112.104 175.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.428 ' H ' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER 74.09 -58.6 0.58 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.542 0.737 . . . . 0.0 110.913 -178.013 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.47 -173.94 3.95 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 57.45 51.89 9.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.173 0.511 . . . . 0.0 110.952 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -90.45 87.98 1.42 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.358 -178.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.74 119.91 37.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.675 0.274 . . . . 0.0 111.068 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.43 71.52 8.44 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.362 0.601 . . . . 0.0 110.38 178.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 169.46 -23.2 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.491 -177.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.07 134.6 49.3 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 123.574 0.22 . . . . 0.0 110.809 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 72.68 -47.93 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.762 0.825 . . . . 0.0 111.983 -178.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.767 ' HA ' HG21 ' A' ' 87' ' ' VAL . 6.9 mt -59.72 -45.81 94.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.843 0.354 . . . . 0.0 110.972 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.88 -37.49 84.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.664 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -70.23 -47.23 62.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.751 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -58.44 -49.04 78.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.992 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.28 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.259 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.81 -49.1 10.84 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.179 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -56.81 -39.28 73.89 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 122.72 0.408 . . . . 0.0 111.658 -177.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.467 HG21 HD11 ' A' ' 96' ' ' LEU . 76.0 mt -57.72 -43.8 84.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.995 0.426 . . . . 0.0 110.61 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HA ' ' HZ ' ' A' ' 98' ' ' PHE . 31.8 mttp -65.09 -47.77 76.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.927 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.47 -39.35 79.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.392 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.53 -46.63 75.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.047 0.451 . . . . 0.0 110.677 178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.7 mt -62.96 -50.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.287 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.495 ' CD ' ' HB2' ' A' ' 101' ' ' HIS . 0.0 OUTLIER -64.13 -20.82 66.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.037 -176.659 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 60.1 m -67.45 -11.84 58.84 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.77 0.319 . . . . 0.0 111.049 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.423 ' HE2' ' HA ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -113.17 9.81 18.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.091 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.563 ' CG ' ' HB1' ' A' ' 34' ' ' ALA . 1.9 m-30 -113.24 144.61 42.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.479 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -115.4 -75.94 0.58 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.017 0.437 . . . . 0.0 110.312 177.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -96.13 0.42 51.29 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 121.827 0.822 . . . . 0.0 110.455 178.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.563 ' HB1' ' CG ' ' A' ' 31' ' ' PHE . . . -77.93 -36.08 49.79 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.017 -1.447 . . . . 0.0 110.3 174.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.49 ' HB3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -75.84 -18.01 59.62 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.792 176.764 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.6 m -97.61 45.61 1.03 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.323 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.64 37.65 2.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.953 -178.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.05 -14.2 33.67 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.655 -174.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.69 -17.03 76.31 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.075 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt -115.19 146.47 41.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.989 0.423 . . . . 0.0 110.398 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.28 168.7 11.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.602 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 4.7 t -152.89 57.64 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.049 0.452 . . . . 0.0 110.522 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 m -69.36 114.13 7.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.809 0.338 . . . . 0.0 110.219 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.33 124.28 49.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.805 -176.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.557 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -77.63 97.32 5.06 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 174.567 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.503 HD12 HD12 ' A' ' 96' ' ' LEU . 1.1 pt -121.41 145.54 27.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -174.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -127.94 115.34 18.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.384 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.9 mt -94.54 125.02 38.92 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.741 -175.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.453 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -75.26 148.1 83.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.392 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.652 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 2.4 Cg_endo -48.87 -28.4 13.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.899 3.066 . . . . 0.0 113.621 -176.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.46 7.49 9.71 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.32 46.65 9.86 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.378 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.453 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.51 139.12 26.57 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.165 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.63 122.57 24.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.857 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.2 pp -93.81 -31.16 14.48 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -129.48 138.44 51.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.634 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.425 HG12 HD22 ' A' ' 71' ' ' LEU . 3.2 tt -159.15 106.9 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.232 0.539 . . . . 0.0 110.101 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -145.43 139.98 15.47 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.904 -175.331 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 14.9 Cg_exo -66.23 120.67 7.84 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.604 2.203 . . . . 0.0 111.196 176.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -102.53 -49.52 3.83 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.421 -175.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -145.9 111.2 0.57 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.278 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 160.3 -161.95 32.92 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.117 -1.04 . . . . 0.0 112.587 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 14.8 t70 -78.75 129.85 72.48 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 120.752 0.311 . . . . 0.0 110.689 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.456 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 31.2 Cg_exo -62.25 -34.03 79.34 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.071 2.514 . . . . 0.0 112.929 -176.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -79.62 -41.76 26.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.92 0.391 . . . . 0.0 110.627 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.413 ' CB ' ' HB3' ' A' ' 63' ' ' ASP . 31.2 tp -59.21 -52.88 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.687 178.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 60.3 m -73.22 -15.13 61.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.716 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -72.68 -39.07 67.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.179 0.514 . . . . 0.0 109.873 174.283 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.86 62.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.379 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.406 ' HA ' ' HZ ' ' A' ' 31' ' ' PHE . . . -60.84 -38.01 84.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.198 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 3.0 mt -61.92 -41.41 97.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.139 0.495 . . . . 0.0 110.278 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.71 71.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.809 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.97 91.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.47 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.66 -30.45 71.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.869 0.366 . . . . 0.0 111.343 -178.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -32.79 58.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.352 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -31.69 36.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.681 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.423 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . . . -70.74 157.61 37.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.981 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.29 94.14 4.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.605 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.417 HD12 HG12 ' A' ' 23' ' ' ILE . 33.1 mm -76.33 122.09 86.11 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.803 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.7 153.79 76.62 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.681 2.254 . . . . 0.0 111.675 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.605 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 0.9 OUTLIER -74.53 147.0 84.43 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 175.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.605 ' HD2' ' HG2' ' A' ' 81' ' ' LYS . 10.6 Cg_endo -52.96 117.03 3.32 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.928 2.419 . . . . 0.0 111.955 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -78.67 -64.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.236 1.958 . . . . 0.0 112.404 -177.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 48.2 m -95.49 159.94 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.153 0.501 . . . . 0.0 111.133 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.9 -27.91 68.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.667 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.35 -50.78 71.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.575 -177.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.767 HG21 ' HA ' ' A' ' 16' ' ' ILE . 4.1 p -74.76 -22.66 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.288 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -62.04 -35.95 80.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.289 0.566 . . . . 0.0 110.657 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.612 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.65 -18.0 55.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.138 -178.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.06 -53.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.927 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.652 ' HZ ' ' HA ' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -61.82 -19.03 62.11 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -171.184 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.612 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 8.8 ptpt -73.22 -6.54 46.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.59 -178.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -162.19 50.92 0.2 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.967 0.413 . . . . 0.0 111.15 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -132.84 105.49 12.74 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.228 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.557 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 3.0 Cg_exo -73.77 139.9 28.41 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.707 2.271 . . . . 0.0 110.923 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.503 HD12 HD12 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -89.56 127.53 35.89 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.066 0.46 . . . . 0.0 111.366 -175.053 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -93.07 94.35 8.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 173.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.527 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 0.3 OUTLIER -88.18 137.75 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.652 -171.658 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -137.73 112.51 9.06 Favored Pre-proline 0 C--N 1.319 -0.752 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.8 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -45.56 127.73 9.88 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 123.608 2.872 . . . . 0.0 113.752 -173.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.495 ' HB2' ' CD ' ' A' ' 28' ' ' GLU . 1.8 m80 -75.93 79.56 2.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.121 -175.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.165 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.871 173.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -106.65 -57.5 2.05 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 69.25 -57.95 0.52 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 124.072 0.858 . . . . 0.0 111.332 179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 165.03 0.31 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.3 m120 64.45 19.05 11.66 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.299 0.639 . . . . 0.0 110.809 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.87 72.03 8.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.859 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.1 tttt -139.39 138.2 36.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.012 -177.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -81.26 74.65 8.25 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.49 166.13 10.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.71 -174.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.0 -142.66 15.52 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.643 -176.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 15' ' ' ASP . . . -140.16 96.48 3.06 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.649 0.261 . . . . 0.0 110.722 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.06 -21.97 60.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.399 179.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.488 ' O ' ' HB1' ' A' ' 14' ' ' ALA . . . -72.01 135.83 23.34 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 173.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.488 ' HB1' ' O ' ' A' ' 13' ' ' GLY . . . 76.39 -32.39 0.2 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.56 0.744 . . . . 0.0 111.08 -173.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.445 ' H ' ' C ' ' A' ' 13' ' ' GLY . 11.2 t0 -61.37 -50.85 71.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.898 0.38 . . . . 0.0 110.364 176.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.523 HG12 HG23 ' A' ' 87' ' ' VAL . 22.9 mt -65.28 -41.07 90.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.688 177.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -59.41 -45.08 92.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.778 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -67.38 -48.57 67.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.938 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.536 ' HD2' ' HG2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -60.52 -34.78 74.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.624 -176.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.54 96.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.961 0.41 . . . . 0.0 110.995 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.34 -29.22 62.43 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.891 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -62.67 -37.22 85.55 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 122.148 0.179 . . . . 0.0 111.008 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 12.8 mt -58.39 -44.8 89.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.022 0.439 . . . . 0.0 110.717 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -64.3 -45.42 88.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.084 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -72.45 -31.12 65.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.428 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.39 -45.95 83.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.038 0.447 . . . . 0.0 111.081 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.461 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 57.9 mt -60.84 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.123 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.466 ' HG2' ' HA ' ' A' ' 32' ' ' TYR . 2.1 tt0 -74.25 -21.29 59.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.563 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.8 m -67.53 -17.23 64.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.055 0.455 . . . . 0.0 109.816 175.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.7 -47.97 4.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.496 172.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.423 ' CA ' ' HB1' ' A' ' 34' ' ' ALA . 3.8 m-30 -107.53 84.52 1.98 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.512 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.466 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -68.29 -90.77 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.874 0.368 . . . . 0.0 111.455 -176.93 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' A' ' 36' ' ' SER . 0.0 OUTLIER -80.39 6.06 13.23 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 122.455 1.122 . . . . 0.0 109.496 174.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.461 ' H ' ' C ' ' A' ' 32' ' ' TYR . . . -76.03 -31.86 59.08 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 112.937 -1.938 . . . . 0.0 109.988 170.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.453 ' O ' ' HB3' ' A' ' 100' ' ' PRO . 60.4 m -77.51 -18.08 57.37 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.16 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.411 ' HB2' ' O ' ' A' ' 33' ' ' ASP . 0.5 OUTLIER -68.09 95.58 0.57 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.38 179.024 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -123.26 -68.51 0.87 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.397 -174.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -174.8 -160.15 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.708 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -94.03 51.78 2.22 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 172.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.92 166.41 12.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.19 0.519 . . . . 0.0 111.684 -174.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.3 152.07 36.47 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.829 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.478 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -163.56 90.33 0.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.156 0.503 . . . . 0.0 110.937 -179.601 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.745 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -70.87 116.88 11.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.409 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.2 mt -99.06 118.13 35.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.7 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.2 ttt180 -80.53 101.14 8.95 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.405 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -120.26 137.24 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.36 0.6 . . . . 0.0 111.588 -175.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.604 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -129.8 109.23 10.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.107 -0.952 . . . . 0.0 108.605 174.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.51 144.07 36.65 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.529 0.681 . . . . 0.0 111.627 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -100.48 161.5 23.8 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.577 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.651 ' HG3' ' HB2' ' A' ' 88' ' ' TYR . 36.4 Cg_exo -57.45 -14.19 15.62 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.041 2.494 . . . . 0.0 112.699 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.22 -11.89 59.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.107 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.2 34.64 23.06 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.886 -179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.47 144.44 47.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.787 0.327 . . . . 0.0 110.238 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.464 HD11 HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -100.09 97.21 8.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.8 178.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -29.8 63.62 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.438 -177.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.604 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -129.07 127.09 40.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.319 176.793 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.635 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.0 OUTLIER -159.08 108.77 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.339 -175.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -158.0 151.38 18.95 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -72.45 119.81 6.35 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.926 2.417 . . . . 0.0 111.963 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.745 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 74.3 mt-10 -82.37 -65.06 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.143 0.496 . . . . 0.0 109.766 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -143.77 123.6 2.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.384 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.478 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 173.84 -178.02 45.89 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.375 -0.917 . . . . 0.0 112.795 -178.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.34 129.63 90.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.37 -47.82 25.3 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.939 2.426 . . . . 0.0 112.649 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.26 -46.88 75.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.192 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.558 HD22 ' HG3' ' A' ' 100' ' ' PRO . 29.6 tp -58.96 -55.31 36.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.122 -179.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.648 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.8 m -63.3 -31.74 72.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.045 -177.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -63.83 -46.34 85.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.77 0.319 . . . . 0.0 110.592 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.19 -34.2 74.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.534 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.3 78.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.227 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 51.8 mt -59.96 -44.43 94.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.101 0.477 . . . . 0.0 110.56 178.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.75 73.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.827 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.461 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -64.11 -45.34 89.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.75 -178.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.14 -35.34 80.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.906 0.384 . . . . 0.0 111.155 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -68.57 -32.84 73.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.545 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.3 mp -80.48 -32.04 37.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.856 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.11 130.37 43.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.659 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -88.38 84.68 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.503 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mt -70.84 132.18 87.07 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.602 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.536 ' HG2' ' HD2' ' A' ' 19' ' ' TYR . 18.9 Cg_endo -61.83 125.26 16.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.747 2.298 . . . . 0.0 112.083 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.442 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -75.33 132.39 76.19 Favored Pre-proline 0 N--CA 1.443 -0.798 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.417 -178.832 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -52.92 115.71 2.44 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.959 2.44 . . . . 0.0 112.712 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -81.14 -69.51 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.95 2.434 . . . . 0.0 111.214 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.67 146.65 49.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.596 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.23 -26.76 68.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.855 0.36 . . . . 0.0 111.446 -175.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.07 -27.44 69.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.108 178.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.523 HG23 HG12 ' A' ' 16' ' ' ILE . 13.6 t -77.26 -32.2 18.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.651 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -61.92 -35.5 78.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.06 0.457 . . . . 0.0 110.225 178.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.525 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -67.74 -27.17 66.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.171 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 87' ' ' VAL . 40.3 t -68.24 -57.32 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.214 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.431 ' HD1' ' HA ' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -85.5 3.35 40.79 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -176.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.525 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -63.82 -23.94 67.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.915 0.388 . . . . 0.0 110.411 178.469 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -163.62 78.22 0.41 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.749 174.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -135.47 84.25 34.96 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.144 -177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.7 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 4.3 Cg_exo -74.4 104.68 1.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.786 2.324 . . . . 0.0 110.629 177.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.82 140.67 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.21 -174.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.523 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 4.8 t70 -87.45 112.35 22.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.845 177.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -86.81 111.37 20.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.076 0.465 . . . . 0.0 110.595 -177.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 mtmm -105.02 138.58 19.55 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.555 176.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.558 ' HG3' HD22 ' A' ' 66' ' ' LEU . 76.3 Cg_exo -53.23 109.45 0.36 Allowed 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.338 2.692 . . . . 0.0 112.951 -177.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -61.39 143.18 56.25 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.928 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.926 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.863 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.604 0.24 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' A' ' 3' ' ' PHE . 0.0 OUTLIER -70.14 -54.52 12.57 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.503 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 2.0 m-85 74.6 -47.14 0.62 Allowed 'General case' 0 N--CA 1.472 0.644 0 O-C-N 124.034 0.834 . . . . 0.0 111.209 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 158.09 -149.76 20.27 Favored Glycine 0 N--CA 1.438 -1.225 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 -175.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -138.52 136.73 36.4 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 117.679 0.74 . . . . 0.0 110.84 175.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.04 108.21 18.15 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.459 ' HZ3' ' CD ' ' A' ' 89' ' ' GLU . 0.4 OUTLIER -119.94 151.33 39.09 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.993 0.425 . . . . 0.0 110.668 -178.212 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -151.6 132.3 14.02 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.104 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -142.9 17.43 1.96 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.968 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.99 -101.64 0.9 Allowed Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.396 -176.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.95 115.54 4.49 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 175.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -69.46 0.28 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.39 -178.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 145.32 -89.77 0.16 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 119.996 -1.097 . . . . 0.0 113.609 174.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.24 -41.05 71.63 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -173.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -50.52 73.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.648 0.261 . . . . 0.0 111.228 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.429 ' HA ' ' HD2' ' A' ' 19' ' ' TYR . 7.9 mt -62.78 -44.87 99.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.985 -179.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -66.07 -32.83 74.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.962 0.41 . . . . 0.0 110.853 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -69.65 -50.22 46.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.681 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.429 ' HD2' ' HA ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -62.87 -34.63 77.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.008 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.55 87.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.062 0.458 . . . . 0.0 110.246 175.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.54 -33.02 75.73 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.234 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -60.69 -36.02 77.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.867 0.365 . . . . 0.0 110.78 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.459 ' HA ' HD12 ' A' ' 23' ' ' ILE . 0.4 OUTLIER -62.61 -40.72 89.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.41 0.624 . . . . 0.0 109.404 177.837 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.462 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 13.1 mttt -66.06 -48.06 72.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.298 178.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 m -54.22 -36.73 63.8 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.798 0.332 . . . . 0.0 111.6 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.85 86.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.011 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -77.18 -42.11 31.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.439 -177.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 59.2 mt-10 -55.33 -38.62 68.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.677 -177.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.64 15.34 14.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.886 -176.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.433 ' HD3' ' HB3' ' A' ' 76' ' ' LEU . 67.9 mttt -151.4 33.48 0.57 Allowed 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.766 ' HB2' ' H ' ' A' ' 35' ' ' SER . 21.8 p90 -58.59 -49.82 76.08 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 113.887 -1.506 . . . . 0.0 113.316 -167.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER 67.77 -70.1 0.13 Allowed 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.357 0.41 . . . . 0.0 110.334 -171.263 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -136.63 20.27 3.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.741 0.781 . . . . 0.0 110.424 175.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.644 ' O ' ' HB3' ' A' ' 100' ' ' PRO . . . -80.6 -56.97 3.8 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.681 177.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.766 ' H ' ' HB2' ' A' ' 31' ' ' PHE . 43.8 m -66.67 -16.67 64.37 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -174.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -20.46 61.14 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -170.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -127.45 64.52 1.34 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.592 ' HA ' ' HB2' ' A' ' 100' ' ' PRO . . . -70.5 121.77 18.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.067 172.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 132.58 -28.9 3.35 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -175.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.81 159.49 21.4 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 174.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.5 139.01 45.15 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.87 107.99 4.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.985 0.421 . . . . 0.0 111.151 -176.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.4 m -74.97 112.91 11.68 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.2 mt -103.69 122.48 45.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.934 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.58 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -78.63 102.95 8.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.888 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.747 HD12 ' HB2' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -101.29 110.33 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.279 -176.933 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -101.98 98.39 8.61 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.93 177.814 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.04 131.24 46.12 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.269 0.557 . . . . 0.0 111.07 -174.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.85 153.66 85.01 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.691 176.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.06 -27.01 34.6 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.186 2.591 . . . . 0.0 113.296 -178.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -77.35 -5.07 48.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.244 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.15 42.21 6.75 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.642 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -127.82 149.39 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 177.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.43 105.64 12.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.451 ' HG ' ' HB3' ' A' ' 47' ' ' LYS . 1.5 pp -88.19 -24.28 23.34 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.504 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.529 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 26.0 t0 -154.68 111.09 3.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.977 179.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -121.51 106.6 18.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -133.66 129.12 20.27 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -172.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 12.6 Cg_exo -66.68 127.07 16.44 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.557 2.171 . . . . 0.0 110.919 175.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -90.28 -65.77 0.99 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.251 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.67 145.82 13.98 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.639 -0.791 . . . . 0.0 111.72 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 151.82 -136.16 5.35 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.866 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.51 119.21 59.41 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -53.53 -41.16 75.65 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.988 2.459 . . . . 0.0 113.064 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.67 -48.79 53.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.671 0.272 . . . . 0.0 110.933 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.8 tp -59.09 -46.39 88.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.693 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.5 m -61.4 -42.03 98.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.266 -177.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -40.2 94.96 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.723 0.296 . . . . 0.0 110.822 179.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.05 -38.75 82.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.577 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.23 -36.53 82.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.023 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.693 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 45.3 mt -60.63 -45.1 95.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.696 177.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.1 -43.89 90.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.13 -48.71 77.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.115 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.5 -24.45 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.401 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -67.19 -38.13 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.012 0.434 . . . . 0.0 110.426 178.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.441 ' HA ' HD13 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -91.69 -17.75 24.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.707 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.27 138.17 58.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.189 -177.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.469 ' HA ' ' HD2' ' A' ' 78' ' ' LYS . 0.4 OUTLIER -82.25 86.36 6.67 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.005 178.638 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 30.5 mm -82.61 121.02 77.74 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.865 178.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -82.07 146.78 14.52 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.485 2.124 . . . . 0.0 112.219 -176.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.52 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -61.64 147.91 87.8 Favored Pre-proline 0 N--CA 1.446 -0.655 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.418 178.597 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.93 112.64 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.653 2.902 . . . . 0.0 113.524 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.53 -26.97 13.48 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.701 2.267 . . . . 0.0 112.284 -177.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.8 152.62 38.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.107 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -63.38 -34.98 78.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.862 -176.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.58 67.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.065 0.46 . . . . 0.0 110.77 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 88.1 t -68.37 -32.2 54.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.096 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.404 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -59.77 -42.11 92.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.986 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.488 ' H ' ' HG2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -79.81 -39.1 31.51 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.044 -0.262 . . . . 0.0 111.488 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.2 t -70.22 -46.46 71.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.501 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 0.1 OUTLIER -63.54 -13.95 46.42 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.586 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 88' ' ' TYR . 18.1 mtmt -69.13 -5.83 24.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.861 0.362 . . . . 0.0 110.695 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -169.2 69.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.501 ' HB1' ' HA ' ' A' ' 91' ' ' PHE . . . -127.51 84.37 63.56 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.529 -174.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.58 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 11.5 Cg_exo -74.24 105.8 2.1 Favored 'Trans proline' 0 CA--C 1.53 0.322 0 C-N-CA 123.158 2.572 . . . . 0.0 111.8 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.747 ' HB2' HD12 ' A' ' 46' ' ' ILE . 2.7 mp -89.57 150.67 22.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.997 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.441 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 1.7 t0 -92.59 97.26 10.7 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -68.37 128.16 35.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.197 0.522 . . . . 0.0 111.418 -175.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.84 112.02 18.79 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.345 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.644 ' HB3' ' O ' ' A' ' 34' ' ' ALA . 51.1 Cg_exo -56.5 138.74 85.5 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 123.141 2.56 . . . . 0.0 111.89 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -88.9 154.17 20.46 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.021 -175.265 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 38' ' ' ALA . 7.8 t-80 . . . . . 0 C--O 1.246 0.915 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.48 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 120.733 0.301 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -111.33 155.3 23.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.423 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -109.96 -42.6 4.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 174.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 71.91 -134.01 21.4 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.696 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.52 67.12 1.15 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -46.69 85.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.139 -175.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.2 tttt 55.52 63.28 2.12 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.541 0.526 . . . . 0.0 110.621 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -59.38 121.6 11.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.477 -179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -146.36 -88.14 0.1 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.239 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.89 139.03 4.43 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.524 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.552 ' H ' HG23 ' A' ' 90' ' ' VAL . . . -93.07 163.77 13.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.673 0.273 . . . . 0.0 111.097 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.53 -48.85 24.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.105 -177.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.422 ' HA2' ' HB ' ' A' ' 16' ' ' ILE . . . 167.07 -99.2 0.15 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.427 -0.892 . . . . 0.0 112.677 179.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 62.42 -89.85 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.967 0.507 . . . . 0.0 111.475 -177.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -76.16 -16.81 59.79 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.334 0.588 . . . . 0.0 110.81 178.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.448 ' O ' HG22 ' A' ' 16' ' ' ILE . 49.5 mm -69.13 -26.36 31.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.115 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -57.64 -47.1 83.17 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -65.17 -44.81 87.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.715 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -44.43 96.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.701 178.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.53 95.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.806 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.49 -43.87 97.51 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.981 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -66.79 -38.52 86.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.535 0.207 . . . . 0.0 111.04 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.481 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 63.6 mt -65.32 -48.55 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.866 0.365 . . . . 0.0 110.576 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -63.37 -24.93 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.142 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 m -78.77 -45.43 21.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.439 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.96 -40.81 73.77 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.238 0.542 . . . . 0.0 110.879 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 5.8 mt -61.69 -46.18 97.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.048 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.56 -21.13 63.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.522 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -68.59 -11.76 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.873 0.368 . . . . 0.0 110.664 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.433 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 3.1 mptp? -103.41 -47.07 4.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.028 176.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -104.97 69.7 0.88 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.157 176.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.468 ' C ' ' H ' ' A' ' 34' ' ' ALA . 1.1 p90 -55.07 117.07 3.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.881 -175.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 t0 64.01 -1.25 0.7 Allowed 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 115.025 -0.989 . . . . 0.0 112.763 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.468 ' H ' ' C ' ' A' ' 32' ' ' TYR . . . -81.67 -47.85 12.46 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.089 173.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.78 -22.81 49.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.456 178.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.78 84.81 7.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.508 -175.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.498 ' HB3' ' H ' ' A' ' 38' ' ' ALA . 0.9 OUTLIER -96.38 -144.17 0.28 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.042 175.913 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.763 ' HA ' ' HG3' ' A' ' 100' ' ' PRO . . . -161.87 144.02 11.47 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.561 -0.163 . . . . 0.0 110.561 177.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.11 46.45 92.67 Favored Glycine 0 C--N 1.332 0.31 0 O-C-N 123.535 0.522 . . . . 0.0 113.097 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.25 137.1 21.76 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 179.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -121.06 107.69 12.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.776 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.581 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.3 OUTLIER -104.95 114.6 28.91 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.978 0.418 . . . . 0.0 111.04 -177.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -86.9 99.12 11.62 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.182 176.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.2 mt -85.39 113.03 21.38 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.865 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -74.65 112.67 11.08 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.254 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.639 HD11 ' HB2' ' A' ' 96' ' ' LEU . 1.3 pt -131.88 123.05 50.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.815 -171.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 mtmm -102.68 98.93 8.89 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.58 HD23 ' HD2' ' A' ' 91' ' ' PHE . 4.9 tp -93.62 113.07 25.08 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.045 0.45 . . . . 0.0 110.343 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.64 150.08 87.36 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.226 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.763 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 16.3 Cg_endo -58.28 -6.94 3.3 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 123.206 2.604 . . . . 0.0 113.086 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.91 -4.11 56.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.734 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.4 62.65 2.04 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.54 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.99 139.58 9.95 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.442 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -88.93 104.84 17.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.87 0.367 . . . . 0.0 111.0 -178.065 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.09 -37.94 28.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.155 0.502 . . . . 0.0 109.966 177.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -124.51 121.95 36.26 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.108 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.436 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 4.2 tt -143.35 110.35 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.879 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -140.79 143.39 31.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.356 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.498 ' HG3' HD23 ' A' ' 71' ' ' LEU . 8.8 Cg_exo -70.54 103.73 1.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.246 1.964 . . . . 0.0 111.33 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -70.33 -49.67 47.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.055 0.455 . . . . 0.0 110.025 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -173.71 137.74 4.21 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.843 177.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.581 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 168.61 -102.7 0.19 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.429 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -143.01 128.15 9.97 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -55.48 -37.22 95.14 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.799 2.333 . . . . 0.0 112.907 -177.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.99 -48.95 16.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.447 HD12 ' HD2' ' A' ' 37' ' ' TYR . 34.6 tp -63.33 -45.04 93.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.454 ' O ' HD22 ' A' ' 71' ' ' LEU . 4.1 m -65.39 -43.89 89.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.795 -175.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -57.33 -49.81 74.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.742 0.306 . . . . 0.0 110.739 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.66 -29.17 70.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.662 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.16 -51.58 8.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.532 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.498 HD23 ' HG3' ' A' ' 59' ' ' PRO . 0.9 OUTLIER -65.31 -39.22 92.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.318 -176.135 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.539 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . . . -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.1 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.06 -33.45 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.427 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.0 -28.89 68.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.539 ' HD2' ' HA ' ' A' ' 72' ' ' ALA . 8.9 mttm -71.75 -22.78 61.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.071 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.433 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -100.95 -19.97 15.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.174 -177.548 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.41 132.94 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.562 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 91.23 8.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.518 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.449 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 38.7 mm -72.22 121.64 85.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.359 179.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 29.5 Cg_exo -64.11 153.19 77.64 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.823 2.349 . . . . 0.0 112.042 -177.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 135.25 88.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 116.21 3.03 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.124 2.55 . . . . 0.0 113.179 -173.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -79.64 -50.01 0.07 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.655 2.237 . . . . 0.0 112.157 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.85 156.8 23.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.772 0.32 . . . . 0.0 110.863 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.89 -27.48 57.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.932 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 90' ' ' VAL . . . -60.76 -40.77 93.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.69 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.433 ' HA ' HD11 ' A' ' 16' ' ' ILE . 9.2 t -61.9 -42.55 95.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.528 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 0.7 OUTLIER -58.79 -32.26 69.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.524 178.472 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.474 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 2.7 mm-40 -75.91 -30.23 58.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.885 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 86' ' ' ALA . 5.4 t -92.42 -53.42 8.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -173.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.763 ' HZ ' ' HA ' ' A' ' 50' ' ' PRO . 0.1 OUTLIER -61.72 -13.11 20.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -168.707 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.474 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.3 ptpt -75.33 -13.63 60.43 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.952 -177.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -169.21 22.16 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.464 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -121.38 123.64 27.57 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 121.752 -0.592 . . . . 0.0 111.27 177.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.865 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.3 Cg_exo -72.7 156.78 53.06 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.191 2.594 . . . . 0.0 112.204 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.639 ' HB2' HD11 ' A' ' 46' ' ' ILE . 0.6 OUTLIER -95.75 132.79 40.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.419 -175.456 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 112.64 19.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.305 174.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -106.35 122.78 46.95 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.296 0.569 . . . . 0.0 110.843 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.551 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -150.66 163.32 24.38 Favored Pre-proline 0 C--N 1.312 -1.024 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.499 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.763 ' HG3' ' HA ' ' A' ' 38' ' ' ALA . 5.9 Cg_exo -40.07 106.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.647 2.898 . . . . 0.0 112.324 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 16.1 p80 -67.28 153.15 44.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.479 -173.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 9.0 p80 . . . . . 0 C--O 1.248 0.983 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.098 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 2' ' ' GLU . . . . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 1' ' ' ALA . 2.0 mp0 70.27 -57.91 0.56 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.486 172.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.66 164.52 36.75 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.54 84.83 0.53 Allowed Glycine 0 N--CA 1.451 -0.304 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -80.33 48.17 0.99 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.156 0.503 . . . . 0.0 111.296 -174.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.14 -43.06 22.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.506 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 56.95 -137.75 1.0 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.35 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -116.25 85.28 2.27 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -92.59 122.33 34.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.745 -0.662 . . . . 0.0 112.155 -171.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.46 -41.98 0.6 Allowed Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.787 176.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -91.73 96.68 10.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.965 0.412 . . . . 0.0 110.737 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.55 117.86 13.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.16 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -123.16 -139.63 5.51 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.193 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -129.67 -55.13 1.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.002 0.429 . . . . 0.0 110.942 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.23 -20.63 63.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.984 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.408 ' HA ' HG23 ' A' ' 87' ' ' VAL . 13.9 mt -67.01 -47.8 81.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.922 0.391 . . . . 0.0 110.365 174.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -34.05 70.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.112 0.482 . . . . 0.0 109.926 177.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -63.81 -39.74 94.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.881 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.43 -40.34 82.24 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.083 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.86 -49.67 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.266 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.78 -31.58 73.21 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.052 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -34.12 70.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.606 0.241 . . . . 0.0 110.676 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 60.0 mt -66.39 -41.44 88.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.13 83.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.821 176.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 m -66.79 -38.14 85.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 0.0 110.569 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.04 -34.95 77.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.214 0.531 . . . . 0.0 110.779 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.492 HD12 HG23 ' A' ' 27' ' ' ILE . 5.5 mt -83.32 -56.25 6.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.626 -176.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 31' ' ' PHE . 43.6 mt-10 -75.48 -22.32 57.32 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.595 -170.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -80.42 8.48 7.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.698 -0.627 . . . . 0.0 110.288 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.98 12.39 11.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 172.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.431 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -108.87 137.61 46.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.508 -177.248 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -85.6 -83.81 0.17 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.814 0.34 . . . . 0.0 111.004 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -78.31 -18.36 55.32 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.546 0.688 . . . . 0.0 111.371 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.604 ' HA ' ' CD2' ' A' ' 37' ' ' TYR . . . -77.28 -29.4 53.82 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.873 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -17.8 63.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.002 0.43 . . . . 0.0 110.797 177.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 m -109.41 20.94 17.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.961 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.604 ' CD2' ' HA ' ' A' ' 34' ' ' ALA . 5.1 m-30 -96.45 173.26 7.45 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.677 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.453 ' HA ' ' HG2' ' A' ' 100' ' ' PRO . . . -172.72 166.53 5.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.833 175.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.81 43.4 91.73 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.333 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.2 mmtt -137.94 158.92 43.34 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.26 138.7 40.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.885 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.44 93.38 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.159 0.504 . . . . 0.0 111.65 -176.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.6 m -76.49 113.78 14.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.216 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.22 125.62 54.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 177.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.934 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 12.4 ttm105 -78.48 98.35 6.03 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.023 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -105.33 155.32 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.256 -176.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.67 103.08 5.11 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.004 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.497 HD23 ' HA ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -81.82 138.43 35.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.973 0.415 . . . . 0.0 110.991 -177.904 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.526 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.82 163.76 17.43 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.638 176.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.526 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 33.3 Cg_endo -62.43 -11.89 25.07 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.348 2.032 . . . . 0.0 112.062 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.41 -4.35 59.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.912 177.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.96 10.55 84.86 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.606 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.46 154.12 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.744 0.307 . . . . 0.0 110.473 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.36 102.07 14.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.093 179.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.2 -42.78 93.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.143 0.497 . . . . 0.0 110.248 -179.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -128.31 144.26 51.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.2 tt -158.1 106.34 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.365 0.602 . . . . 0.0 109.408 177.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.45 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -135.15 123.63 15.82 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.032 -174.029 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.575 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 21.6 Cg_exo -65.64 120.7 7.93 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.974 2.449 . . . . 0.0 112.15 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -61.86 1.86 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -166.63 -176.71 37.95 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.029 177.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.5 -89.22 0.43 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 -178.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -133.91 110.29 12.01 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 120.78 0.324 . . . . 0.0 110.518 176.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.99 -36.08 95.43 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 122.717 2.278 . . . . 0.0 112.787 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.84 -53.09 12.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.307 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.915 0.388 . . . . 0.0 110.9 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.575 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 8.5 m -64.74 -42.59 95.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.606 -178.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -68.82 -33.59 74.09 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.933 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.54 69.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 178.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.07 71.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 15.2 mt -61.16 -37.06 81.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.788 0.327 . . . . 0.0 111.14 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.27 -40.93 77.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.873 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.13 74.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.035 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.56 -26.91 68.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.383 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -78.05 -22.74 48.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mt -99.39 -11.4 21.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.501 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.11 125.69 27.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.278 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.91 99.14 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.812 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -112.89 124.72 31.11 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.616 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.7 168.41 19.5 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.55 2.167 . . . . 0.0 112.651 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -66.92 127.73 93.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -50.86 110.84 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.31 2.673 . . . . 0.0 112.577 -177.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.74 -27.86 12.16 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.62 2.214 . . . . 0.0 111.457 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.6 ' HB2' HG22 ' A' ' 87' ' ' VAL . 0.6 OUTLIER -107.54 120.05 41.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.154 177.865 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -60.99 -32.07 71.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.12 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.68 78.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.92 0.391 . . . . 0.0 110.913 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 84' ' ' SER . 91.0 t -66.6 -44.62 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -62.41 -43.38 98.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.969 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.795 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 3.3 mm-40 -58.05 -32.52 68.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.31 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.23 -58.2 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.452 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -65.43 -18.94 65.71 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.795 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.73 -13.81 61.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.816 0.341 . . . . 0.0 110.918 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -153.08 46.78 0.69 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 110.695 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.82 101.3 11.7 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.812 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.934 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.6 Cg_exo -72.45 131.75 18.03 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.848 2.365 . . . . 0.0 111.53 -178.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.66 146.03 25.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.251 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -97.07 96.71 8.66 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.967 175.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -73.16 108.86 6.29 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.419 -173.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.69 135.73 25.43 Favored Pre-proline 0 C--N 1.315 -0.902 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.453 ' HG2' ' HA ' ' A' ' 38' ' ' ALA . 51.1 Cg_exo -36.19 126.04 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.913 3.075 . . . . 0.0 113.388 -175.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.406 ' HB3' ' OE2' ' A' ' 28' ' ' GLU . 12.4 p80 -58.3 159.39 6.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.3 -173.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.172 -0.918 . . . . 0.0 109.297 174.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 70.51 -64.36 0.37 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.891 0.744 . . . . 0.0 110.893 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -100.65 138.43 37.71 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.68 24.93 4.14 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.075 -177.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 61.2 t30 54.22 76.16 0.25 Allowed 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.867 0.467 . . . . 0.0 111.774 177.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.99 62.56 2.15 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.205 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.69 141.18 29.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.881 -177.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -86.6 68.94 10.31 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.371 0.605 . . . . 0.0 109.512 175.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -76.06 -28.73 57.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.277 -176.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -105.19 -127.09 5.89 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.336 174.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.7 43.49 2.73 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.973 0.416 . . . . 0.0 110.494 178.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.83 88.04 2.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.748 -178.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.35 -5.75 8.48 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.976 -176.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.81 -31.21 64.48 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.836 0.35 . . . . 0.0 111.812 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -75.99 -54.38 6.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.054 0.454 . . . . 0.0 110.428 178.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mt -65.34 -48.06 84.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.447 -175.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -63.36 -37.89 89.04 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -175.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -33.84 76.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.028 0.442 . . . . 0.0 110.413 178.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -73.67 -48.7 30.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.697 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.532 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.81 -34.19 77.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.993 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.14 -35.95 91.19 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.191 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -65.85 -42.56 90.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.845 0.355 . . . . 0.0 110.994 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.532 HD12 ' HA ' ' A' ' 20' ' ' ALA . 44.8 mt -57.93 -44.29 86.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.37 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.2 mttp -55.16 -44.27 75.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.541 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.55 -36.67 44.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.975 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.17 -38.31 79.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.677 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 23' ' ' ILE . 6.3 mt -65.43 -38.32 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.985 -178.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -19.28 62.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.415 177.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -68.99 -23.64 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.149 0.5 . . . . 0.0 110.04 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 14.6 mmmt -96.18 -48.38 5.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.572 174.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 -89.97 89.16 7.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.852 176.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -60.56 86.52 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.855 0.359 . . . . 0.0 111.59 -176.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.4 t70 61.82 16.63 8.1 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.878 0.846 . . . . 0.0 110.623 -176.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.71 -42.41 21.98 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.926 178.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.56 -22.77 65.38 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.463 177.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.98 65.8 1.12 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.366 176.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.491 ' HD1' ' HA ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -99.7 -47.05 5.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.348 -173.643 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.463 ' H ' ' HG2' ' A' ' 100' ' ' PRO . . . 68.62 152.52 0.09 Allowed 'General case' 0 N--CA 1.464 0.246 0 O-C-N 124.092 0.87 . . . . 0.0 111.143 -177.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.9 -37.79 2.68 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.187 -0.53 . . . . 0.0 111.962 -176.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.3 129.65 39.32 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.99 145.33 48.23 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.8 106.49 4.26 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.693 -177.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.584 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 20.0 m -78.94 113.33 16.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.661 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -108.63 114.25 27.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.196 -176.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.867 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 21.8 ttm180 -79.42 89.07 5.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.7 pt -95.28 111.88 26.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.569 -172.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -93.94 99.44 11.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.37 177.191 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.9 mt -85.33 139.51 31.52 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.126 0.489 . . . . 0.0 111.379 -175.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -96.0 158.8 33.55 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.279 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.706 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 32.4 Cg_exo -56.0 -24.09 46.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.966 2.444 . . . . 0.0 112.564 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -75.19 -9.08 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.127 -178.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 44.75 6.48 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.774 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 ptt? -150.81 142.46 23.63 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.649 HD11 ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -88.54 101.58 14.08 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.352 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.433 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 0.1 OUTLIER -71.87 -37.22 70.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.409 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.1 t70 -123.73 100.13 6.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -111.57 106.18 20.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -113.94 119.96 39.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.611 -170.347 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.573 ' HG3' HD21 ' A' ' 71' ' ' LEU . 2.7 Cg_exo -71.51 110.9 2.98 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.694 2.263 . . . . 0.0 111.176 175.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -73.8 -49.21 26.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.209 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 173.22 172.9 39.17 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.472 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.8 -90.66 0.24 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -143.45 112.34 5.5 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.32 -35.01 95.44 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.953 2.435 . . . . 0.0 112.275 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.81 83.38 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.283 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.0 tp -88.05 -40.4 13.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.626 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.588 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.6 m -60.64 -55.07 37.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.298 -175.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.489 ' HA ' HD13 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -61.99 -29.72 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.681 0.277 . . . . 0.0 111.455 -176.51 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.95 -44.06 27.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.928 0.394 . . . . 0.0 110.851 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.99 -28.97 69.94 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.464 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 91.2 mt -54.58 -44.84 73.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.652 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.6 -41.19 32.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.68 -50.05 74.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.99 -177.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.19 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.85 0.357 . . . . 0.0 111.49 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.649 ' HG2' HD11 ' A' ' 54' ' ' LEU . 2.8 mtmt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 179.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.7 mp -94.6 -19.76 20.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.878 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.44 158.4 26.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.673 -175.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.03 73.84 5.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.685 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 22.9 mm -76.3 120.07 80.04 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.712 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -63.58 171.56 6.74 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.594 2.196 . . . . 0.0 112.339 -177.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.452 ' HG3' ' HD2' ' A' ' 82' ' ' PRO . 1.1 tppt? -90.98 135.01 29.14 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 175.162 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.452 ' HD2' ' HG3' ' A' ' 81' ' ' LYS . 78.4 Cg_exo -44.16 111.57 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.396 2.731 . . . . 0.0 112.785 -178.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -62.99 -66.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.721 2.28 . . . . 0.0 112.25 -176.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.33 -179.37 3.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.778 0.323 . . . . 0.0 110.637 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -16.49 61.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.073 -177.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.31 -57.8 9.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.467 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.7 t -60.51 -37.57 75.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.63 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.706 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 29.3 t80 -54.0 -52.83 59.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.636 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.501 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 44.6 mm-40 -77.89 -40.81 38.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 111.534 -177.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.497 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 54.5 t -72.68 -52.56 22.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.981 -173.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -72.69 -5.21 36.03 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -176.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 7.4 mtmt -65.92 -21.34 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 171.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.87 55.37 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.709 179.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.497 ' HB2' ' O ' ' A' ' 90' ' ' VAL . . . -123.26 93.53 47.89 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -178.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.867 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.4 Cg_exo -73.73 140.08 28.78 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 123.013 2.475 . . . . 0.0 111.941 -178.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.35 135.08 55.14 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.57 -177.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.584 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 25.5 t0 -84.09 103.32 13.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 175.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.61 108.62 3.92 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.082 -175.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.9 116.82 32.69 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.536 176.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.463 ' HG2' ' H ' ' A' ' 38' ' ' ALA . 51.7 Cg_exo -36.06 114.5 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 124.103 3.202 . . . . 0.0 113.356 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -88.56 142.72 27.46 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.507 -178.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 . . . . . 0 C--O 1.247 0.971 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.069 -179.61 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 121.188 0.518 . . . . 0.0 109.915 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -101.52 134.05 45.22 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.317 -174.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -80.93 46.72 0.92 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.66 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 52.84 46.47 60.28 Favored Glycine 0 C--N 1.333 0.378 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.878 177.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -66.19 119.83 12.16 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.827 0.346 . . . . 0.0 110.539 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.98 84.92 0.22 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.767 -176.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.39 -77.7 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.521 178.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -110.72 -1.6 16.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.164 0.507 . . . . 0.0 109.897 175.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -120.01 168.85 10.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.968 177.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.25 -106.65 1.21 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.204 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -157.71 161.54 38.54 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.26 59.72 1.83 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.255 0.55 . . . . 0.0 111.004 -179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -178.68 38.06 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.002 -178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -101.33 142.84 32.14 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.484 -0.191 . . . . 0.0 110.484 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 65.22 -71.2 0.08 Allowed 'General case' 0 N--CA 1.469 0.485 0 O-C-N 123.92 0.763 . . . . 0.0 112.365 177.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.584 HG22 ' HE1' ' A' ' 91' ' ' PHE . 1.3 mt -55.62 -50.81 64.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.899 0.38 . . . . 0.0 111.6 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -35.36 78.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.973 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -66.47 -48.36 70.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.73 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.45 80.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.298 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.19 -35.56 77.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.765 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.79 -37.12 88.28 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.571 177.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.06 -37.15 86.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.889 0.376 . . . . 0.0 110.632 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 36.1 mt -73.29 -40.07 56.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.409 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.72 -38.0 71.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.433 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.54 -42.81 28.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.867 0.365 . . . . 0.0 110.704 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.61 -47.31 86.07 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.406 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.494 HD12 ' CZ ' ' A' ' 98' ' ' PHE . 4.6 mt -64.39 -39.33 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.311 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -21.18 64.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.459 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.439 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 4.3 m -96.53 17.81 15.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.117 0.484 . . . . 0.0 110.691 177.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 29' ' ' SER . 10.1 mmtt -150.81 32.14 0.62 Allowed 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -62.07 -41.85 98.59 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 113.487 -1.688 . . . . 0.0 113.013 -167.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 69.83 -66.38 0.27 Allowed 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -170.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -149.7 25.34 0.85 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.967 0.889 . . . . 0.0 109.999 170.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.85 -18.91 53.23 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.359 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 p -65.89 -17.82 64.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.522 0.677 . . . . 0.0 110.291 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m -79.35 52.58 1.37 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.616 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.565 ' CD1' ' HB3' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -110.64 -154.12 0.53 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.974 -179.627 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.564 ' H ' ' HG3' ' A' ' 100' ' ' PRO . . . 73.33 118.59 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.736 0.814 . . . . 0.0 111.062 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.02 -22.78 34.1 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -171.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.505 ' HB2' HD23 ' A' ' 66' ' ' LEU . 23.2 mttm -117.65 150.95 38.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.1 -0.55 . . . . 0.0 110.38 176.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.17 149.09 39.27 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.404 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 33.4 t -152.37 116.6 4.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.041 0.448 . . . . 0.0 111.816 -178.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.875 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.9 m -76.03 121.43 22.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.42 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 59' ' ' PRO . 12.7 mt -105.61 129.48 53.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 0.0 110.252 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.592 ' HB3' ' HD2' ' A' ' 58' ' ' LYS . 8.6 ttt-85 -86.86 93.3 9.26 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.82 113.68 34.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.304 -173.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -101.01 100.86 11.53 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 175.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 91' ' ' PHE . 35.2 mt -93.15 130.03 38.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.947 -175.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.39 138.72 67.57 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 172.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.65 -17.82 18.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.349 2.699 . . . . 0.0 113.342 -175.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -81.32 -0.41 40.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.328 . . . . 0.0 111.174 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.67 63.88 1.52 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.564 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.8 ptp -159.68 135.61 8.68 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.489 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -91.26 87.82 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.155 0.503 . . . . 0.0 110.043 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.46 ' HG ' ' N ' ' A' ' 56' ' ' ASP . 0.4 OUTLIER -76.59 -29.43 56.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.378 -178.661 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.46 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 29.7 t70 -130.52 92.52 3.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.38 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 tt -124.36 106.71 17.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.592 ' HD2' ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -134.3 142.6 43.6 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.47 -173.14 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.473 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 8.9 Cg_exo -69.82 132.29 22.92 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.055 2.503 . . . . 0.0 111.504 177.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -98.98 -76.58 0.53 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.418 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -133.14 145.69 17.67 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.467 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 135.69 -154.26 21.71 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.187 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -88.53 120.46 70.32 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -56.01 -27.27 63.31 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.99 2.46 . . . . 0.0 112.859 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.29 -42.64 75.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.706 0.289 . . . . 0.0 110.43 176.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.505 HD23 ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.716 174.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 8.8 m -63.07 -56.23 18.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.506 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -38.11 84.91 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.602 -174.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.53 -41.8 92.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.216 177.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.82 -38.98 87.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.021 177.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 17.8 mt -57.1 -51.35 69.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.929 0.395 . . . . 0.0 110.859 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.44 -44.01 92.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.033 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.448 ' HB2' ' CG2' ' A' ' 27' ' ' ILE . . . -64.74 -40.42 95.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.443 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.93 -33.8 76.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.73 0.3 . . . . 0.0 111.293 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.42 -26.32 60.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.01 0.433 . . . . 0.0 110.635 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -88.01 -31.92 19.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.701 179.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.99 170.63 12.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.354 0.597 . . . . 0.0 111.821 -176.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -114.87 106.3 14.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.552 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.447 HD11 HD22 ' A' ' 54' ' ' LEU . 3.6 mp -103.77 110.4 63.86 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.9 Cg_exo -69.63 153.25 69.78 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.842 2.361 . . . . 0.0 112.558 -175.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -70.54 126.99 92.39 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.501 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.94 112.32 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.954 2.436 . . . . 0.0 113.218 -175.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -77.52 -21.34 11.6 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.62 2.213 . . . . 0.0 111.33 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -97.66 143.25 28.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.074 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.8 mm-40 -72.17 -27.62 62.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.758 0.313 . . . . 0.0 110.862 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.57 -52.03 65.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.284 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 91' ' ' PHE . 53.3 t -67.49 -37.15 78.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.627 177.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.457 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 4.8 t80 -53.72 -50.87 64.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.355 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.433 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.29 -27.12 47.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.093 -174.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.2 t -87.19 -43.01 15.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.896 -0.321 . . . . 0.0 111.507 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.584 ' HE1' HG22 ' A' ' 16' ' ' ILE . 2.5 m-85 -77.8 -0.87 28.78 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -174.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 88' ' ' TYR . 8.5 mttt -57.29 -30.35 64.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.214 0.53 . . . . 0.0 110.478 176.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.518 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 2.8 t-20 -158.3 76.08 0.75 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.465 172.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -107.68 95.35 14.06 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.342 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.518 ' HD3' ' O ' ' A' ' 93' ' ' ASN . 8.0 Cg_exo -73.6 104.5 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.651 2.234 . . . . 0.0 110.448 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.8 130.47 46.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.783 -173.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.875 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 32.9 t70 -75.13 102.1 4.81 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.494 ' CZ ' HD12 ' A' ' 27' ' ' ILE . 0.8 OUTLIER -70.38 116.98 11.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.37 0.605 . . . . 0.0 110.48 -175.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 4.7 tttt -131.62 128.05 21.67 Favored Pre-proline 0 C--N 1.312 -1.046 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.655 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.565 ' HB3' ' CD1' ' A' ' 37' ' ' TYR . 3.2 Cg_exo -33.23 118.72 0.1 OUTLIER 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.861 3.707 . . . . 0.0 111.837 177.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.87 145.68 52.03 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.457 -166.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 . . . . . 0 C--O 1.243 0.761 0 CA-C-N 114.76 -1.109 . . . . 0.0 108.672 175.838 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -59.89 110.16 1.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.653 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 68.74 -75.79 0.06 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.698 0.799 . . . . 0.0 112.099 178.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.25 -126.88 8.81 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 -172.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -118.11 75.45 1.01 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.757 0.313 . . . . 0.0 110.322 174.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.1 m 61.92 112.69 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.582 178.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.55 16.98 8.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.339 0.59 . . . . 0.0 110.32 176.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -113.32 134.9 54.38 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.857 177.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.4 t30 63.75 44.56 4.93 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.333 0.587 . . . . 0.0 110.103 -176.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.8 -163.45 14.34 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.502 -175.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.482 ' HB1' ' H ' ' A' ' 12' ' ' SER . . . -171.92 -114.01 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.482 ' H ' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -79.83 87.68 5.29 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 172.038 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.26 51.4 2.49 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.927 -0.579 . . . . 0.0 113.388 -172.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 18' ' ' ASN . . . -65.72 -25.37 67.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.045 0.45 . . . . 0.0 109.942 175.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -57.7 3.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.399 176.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.8 mt -57.88 -46.66 87.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.45 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.69 -39.97 86.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.987 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.5 t30 -71.96 -41.47 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.037 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.9 -40.02 96.28 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.76 -37.33 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.783 177.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.24 -39.58 43.69 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.386 178.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.407 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -62.68 -26.46 68.67 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.285 0.234 . . . . 0.0 111.429 -178.291 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.407 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 65.2 mt -62.91 -39.22 84.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.233 0.539 . . . . 0.0 110.03 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HB2' ' CE1' ' A' ' 101' ' ' HIS . 29.7 mttt -74.07 -28.99 61.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.179 178.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -67.7 -39.33 84.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.725 0.298 . . . . 0.0 110.691 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.76 -31.78 68.67 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.476 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.516 HG22 ' HB3' ' A' ' 73' ' ' ALA . 43.2 mt -66.18 -31.65 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.665 -176.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.682 ' HA ' ' OG ' ' A' ' 35' ' ' SER . 0.8 OUTLIER -71.69 -33.1 68.53 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.108 -0.37 . . . . 0.0 111.108 179.495 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.24 4.8 1.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.761 178.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 1.6 mmmt -119.36 -0.54 10.92 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.446 ' CE2' ' HB2' ' A' ' 69' ' ' ALA . 0.2 OUTLIER -123.4 -30.51 3.66 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.384 -176.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.418 ' C ' ' H ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER 66.77 75.84 0.31 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 122.819 0.448 . . . . 0.0 110.945 179.204 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.509 ' O ' ' HB2' ' A' ' 36' ' ' SER . 0.0 OUTLIER 60.25 5.01 0.74 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 122.181 0.991 . . . . 0.0 112.224 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 31' ' ' PHE . . . -78.35 -30.96 48.36 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.492 173.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.682 ' OG ' ' HA ' ' A' ' 28' ' ' GLU . 0.7 OUTLIER -68.76 -17.87 64.11 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.823 176.072 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.509 ' HB2' ' O ' ' A' ' 33' ' ' ASP . 39.4 m -76.39 69.74 2.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.998 175.395 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.441 ' HB3' ' H ' ' A' ' 38' ' ' ALA . 2.6 m-85 -88.36 -157.27 0.41 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.952 -175.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.652 ' O ' ' HG3' ' A' ' 100' ' ' PRO . . . -75.32 165.63 24.86 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.011 174.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -70.4 61.03 0.85 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.382 -0.437 . . . . 0.0 113.141 178.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 166.24 12.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.1 m -118.13 121.2 39.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.911 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 6.0 t -115.91 151.09 36.0 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -137.56 102.2 4.7 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 0.0 110.387 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.14 136.12 41.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.409 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.798 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 ptm180 -85.21 124.91 32.4 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -127.7 111.09 23.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 121.167 0.508 . . . . 0.0 111.168 -173.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.62 ' HG3' ' O ' ' A' ' 92' ' ' LYS . 29.1 ttmt -108.0 104.22 13.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.373 -0.83 . . . . 0.0 108.891 176.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 tp -96.37 142.55 28.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.145 0.498 . . . . 0.0 111.898 -173.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -100.19 166.13 13.24 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.824 176.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -61.81 -10.15 16.28 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.756 2.304 . . . . 0.0 112.703 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.35 -6.61 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.477 177.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.428 ' HA3' ' HA ' ' A' ' 81' ' ' LYS . . . 78.36 16.92 78.8 Favored Glycine 0 CA--C 1.51 -0.25 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.89 -177.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -104.84 146.25 29.26 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.44 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -90.12 101.74 14.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -28.06 60.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.094 0.473 . . . . 0.0 110.07 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.552 ' HB3' ' HB3' ' A' ' 47' ' ' LYS . 28.7 t70 -128.93 104.15 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.538 175.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -133.76 111.74 15.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.34 148.09 15.19 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.408 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.531 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 39.3 Cg_endo -70.34 112.91 3.3 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 121.964 1.776 . . . . 0.0 111.656 177.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -73.45 -34.85 65.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.411 0.624 . . . . 0.0 109.589 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 176.88 -177.23 48.2 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.401 177.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.25 -150.84 17.43 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.013 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.3 112.55 42.3 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.784 0.326 . . . . 0.0 110.303 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.46 -40.26 82.54 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.339 2.693 . . . . 0.0 113.399 -174.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.0 -46.71 86.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.951 0.405 . . . . 0.0 111.188 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.409 ' HA ' HD11 ' A' ' 66' ' ' LEU . 16.3 tp -65.61 -38.9 90.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.553 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.531 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 24.9 m -67.93 -44.72 76.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.265 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.511 ' HA ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -62.17 -38.77 90.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.702 0.286 . . . . 0.0 110.822 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.446 ' HB2' ' CE2' ' A' ' 31' ' ' PHE . . . -60.73 -44.76 96.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.642 178.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.3 82.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.075 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.511 HD11 ' HA ' ' A' ' 68' ' ' GLN . 51.7 mt -53.52 -46.64 70.18 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.708 -177.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.13 -37.24 46.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HB3' HG22 ' A' ' 27' ' ' ILE . . . -75.64 -39.6 57.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.112 -175.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.411 ' HA ' ' HB2' ' A' ' 77' ' ' ALA . . . -63.55 -32.01 73.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -176.415 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -67.91 -30.56 69.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.0 110.966 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 57.3 mt -98.23 -2.59 39.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.541 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -78.02 149.07 34.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.442 -179.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.95 66.45 6.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -178.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 53.4 mt -78.51 116.71 61.53 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.878 176.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 23.4 Cg_exo -67.29 151.53 80.66 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 123.011 2.474 . . . . 0.0 112.761 -175.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.496 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -73.86 138.62 76.52 Favored Pre-proline 0 N--CA 1.443 -0.821 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.453 175.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.04 106.92 0.22 Allowed 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.114 2.543 . . . . 0.0 112.835 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -77.16 -25.1 8.96 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.601 2.201 . . . . 0.0 111.832 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.42 135.26 54.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.695 177.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -66.51 -27.83 68.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.956 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.4 -37.26 86.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.141 0.496 . . . . 0.0 110.75 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.99 -33.92 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.292 177.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -69.66 -31.63 69.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.514 176.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.884 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -65.9 -35.38 80.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.396 179.295 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.472 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 51.6 t -79.69 -45.89 22.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.566 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.29 5.32 8.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.178 -176.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.884 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 6.1 ttmt -63.7 -23.69 67.47 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.229 0.538 . . . . 0.0 110.117 176.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -170.07 75.15 0.08 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.292 175.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 90' ' ' VAL . . . -122.09 85.2 46.02 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.452 -173.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.798 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 12.6 Cg_exo -73.05 104.51 1.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.747 2.298 . . . . 0.0 110.725 178.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 41.6 mt -95.24 158.84 15.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.823 -172.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -80.07 146.67 31.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.258 177.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.471 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 64.7 t80 -129.55 130.84 46.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.029 0.443 . . . . 0.0 110.507 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 165.6 34.23 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.652 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 28.4 Cg_endo -60.45 90.44 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.406 2.07 . . . . 0.0 113.202 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.467 ' CE1' ' HB2' ' A' ' 24' ' ' LYS . 1.5 t60 -53.04 128.18 26.56 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.42 -178.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 . . . . . 0 C--O 1.246 0.887 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.336 177.018 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.5 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.981 0.42 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -62.91 -26.88 69.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.91 178.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.256 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.07 -31.11 69.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.469 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.31 64.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.288 0.566 . . . . 0.0 109.879 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.21 -32.28 72.39 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.833 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.449 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -60.06 -30.16 69.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.98 0.39 . . . . 0.0 110.894 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.552 ' O ' HG13 ' A' ' 27' ' ' ILE . 2.6 mt -76.36 -35.12 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.024 0.44 . . . . 0.0 109.954 176.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -62.28 -46.53 88.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.002 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.0 -34.46 75.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.232 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.39 -32.45 72.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.391 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 23' ' ' ILE . 8.5 mt -67.97 -32.81 57.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.707 -176.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -40.08 93.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.639 0.257 . . . . 0.0 111.208 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.41 14.13 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -119.26 -8.55 10.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 176.978 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.723 176.076 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.467 ' HB2' HD22 ' A' ' 66' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.461 0.081 0 CA-C-O 120.895 0.379 . . . . 0.0 110.876 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -141.14 139.66 33.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.785 176.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.623 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 52.8 t -138.05 79.6 1.75 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.47 0.652 . . . . 0.0 110.823 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -70.14 120.99 16.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.012 176.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.585 HD23 ' HA ' ' A' ' 59' ' ' PRO . 67.0 mt -113.64 124.56 52.62 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.91 0.386 . . . . 0.0 110.666 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -81.02 88.17 5.96 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.98 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.3 pt -113.89 152.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.447 -174.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 56' ' ' ASP . 5.0 mtmt -140.33 112.62 7.81 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.375 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 2.3 tp -95.55 118.65 32.65 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 120.915 0.388 . . . . 0.0 110.952 -177.168 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.621 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -67.57 159.05 80.47 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.979 176.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.471 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 37.4 Cg_exo -57.04 -15.91 19.15 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.864 2.376 . . . . 0.0 112.777 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.83 -0.93 57.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.327 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.52 52.94 4.89 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.52 -0.848 . . . . 0.0 112.426 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.71 140.61 23.78 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.16 107.54 17.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.006 0.431 . . . . 0.0 110.657 -178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.621 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -76.6 -37.37 56.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.902 177.54 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.616 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -112.7 140.15 47.72 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.885 178.723 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -158.82 106.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.364 0.602 . . . . 0.0 110.128 177.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.402 ' HG3' ' HD2' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -140.43 127.05 12.02 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.191 -175.463 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.585 ' HA ' HD23 ' A' ' 44' ' ' LEU . 64.1 Cg_endo -76.62 111.08 3.18 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.701 2.267 . . . . 0.0 112.422 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -124.17 21.46 8.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.736 0.779 . . . . 0.0 109.957 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.45 ' HA2' ' HB ' ' A' ' 43' ' ' THR . . . -79.81 -151.84 7.04 Favored Glycine 0 C--N 1.32 -0.345 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.368 -177.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -115.85 -13.02 8.87 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.822 -0.704 . . . . 0.0 113.2 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -117.63 112.46 38.93 Favored Pre-proline 0 C--N 1.327 -0.403 0 O-C-N 122.551 -0.381 . . . . 0.0 110.466 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.445 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 36.7 Cg_endo -68.96 -27.38 30.43 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.691 2.261 . . . . 0.0 112.886 -176.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -77.71 -51.74 10.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.735 0.302 . . . . 0.0 110.85 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.467 HD22 ' HB2' ' A' ' 40' ' ' LYS . 12.8 tp -56.87 -44.05 81.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.387 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.2 m -69.76 -38.89 76.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.914 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.445 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 1.3 mp0 -62.18 -40.83 97.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.011 0.434 . . . . 0.0 110.888 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.72 55.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.032 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.62 -37.94 76.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.812 -178.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 22.0 mt -55.3 -44.03 75.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.771 0.32 . . . . 0.0 111.198 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.41 46.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.267 -178.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.83 91.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.554 -177.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.33 79.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 111.196 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.007 0.432 . . . . 0.0 110.967 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 mt -92.27 -3.6 55.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.694 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -80.08 168.3 19.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -100.56 106.63 18.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 110.906 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mp -119.35 116.89 33.44 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.104 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -78.96 172.44 14.95 Favored 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 122.733 2.289 . . . . 0.0 113.066 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 124.33 89.78 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.195 178.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.488 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 68.7 Cg_exo -53.61 114.99 2.02 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.236 2.624 . . . . 0.0 112.646 -178.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 7.2 Cg_endo -92.14 -75.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.351 2.701 . . . . 0.0 112.903 -174.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.35 134.63 56.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.804 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.77 -36.48 74.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.49 -176.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.01 -47.36 83.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.829 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 83.7 t -66.72 -43.62 89.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.441 178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.471 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 6.1 t80 -60.87 -41.58 96.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.116 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.452 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 16.4 mm-40 -62.92 -24.77 68.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 0.0 111.234 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.406 HG12 ' HB2' ' A' ' 94' ' ' ALA . 93.3 t -92.43 -45.01 14.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.624 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.406 ' HD1' ' HA ' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -59.95 -30.47 69.1 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -175.228 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 48' ' ' LEU . 3.1 ptpt -66.27 -8.22 23.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.731 0.3 . . . . 0.0 111.602 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -164.38 59.94 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.914 0.387 . . . . 0.0 110.114 176.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.406 ' HB2' HG12 ' A' ' 90' ' ' VAL . . . -115.75 89.2 22.72 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.171 -178.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.546 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 2.3 Cg_endo -76.1 103.14 1.69 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.07 1.847 . . . . 0.0 110.399 175.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.0 mt -102.75 153.24 20.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.973 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.573 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -94.38 132.35 39.1 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.023 175.121 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.623 ' O ' ' HB3' ' A' ' 42' ' ' CYS . 82.4 m-85 -113.98 98.92 7.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.473 0.654 . . . . 0.0 110.075 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.681 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -112.23 173.99 2.57 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.608 177.822 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.681 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 35.5 Cg_exo . . . . . 0 C--N 1.356 0.952 0 C-N-CA 123.092 2.528 . . . . 0.0 112.855 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.134 0 CA-C-O 120.675 0.274 . . . . 0.0 111.121 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.32 -29.84 71.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.623 -177.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -62.37 -46.22 89.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.875 0.369 . . . . 0.0 110.741 178.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.68 -28.91 51.2 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.831 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.63 -35.99 82.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 110.33 175.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.1 -33.88 84.71 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.796 177.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -45.72 92.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.2 mt -64.82 -45.68 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.798 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -60.33 -35.92 76.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.016 0.436 . . . . 0.0 110.948 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -72.81 -40.55 65.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.501 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.5 -38.48 77.74 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.739 0.78 . . . . 0.0 110.631 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.544 HG23 ' HB3' ' A' ' 73' ' ' ALA . 8.5 mt -66.04 -43.44 92.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.262 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.12 -22.12 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -178.082 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -26.21 60.78 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.839 177.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.446 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.32 -51.9 7.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.891 174.757 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-O 121.057 0.456 . . . . 0.0 110.006 177.095 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.426 ' HB2' HD22 ' A' ' 66' ' ' LEU . 8.9 mmtp . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.827 0.346 . . . . 0.0 111.234 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.18 156.78 44.73 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.287 176.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.71 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 8.2 t -142.52 151.39 41.58 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.0 m -125.16 103.23 7.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.218 0.532 . . . . 0.0 110.907 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.8 mt -92.59 113.18 25.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.009 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.725 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.3 mmt-85 -81.73 88.17 6.29 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.2 pt -101.04 151.74 5.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.074 -174.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HB3' ' HE2' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -134.7 89.17 2.51 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.92 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.6 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 1.6 tp -80.74 123.2 28.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.393 -172.565 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.434 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -74.31 152.29 87.95 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 173.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -57.37 -16.4 22.76 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.053 2.502 . . . . 0.0 112.58 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.88 -14.34 62.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.723 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.05 59.94 2.23 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.807 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.97 146.11 20.21 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.36 82.1 2.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.321 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.477 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -73.9 -19.57 60.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 177.801 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.482 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -125.05 117.26 23.57 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.488 177.391 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.5 tt -159.46 111.03 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.499 . . . . 0.0 110.531 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.5 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -137.74 135.05 18.58 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.183 -177.238 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.747 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 2.0 Cg_endo -80.64 74.36 5.58 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.414 2.743 . . . . 0.0 111.308 177.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.611 ' HB2' ' HG3' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -65.37 -34.15 77.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.081 -175.503 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -144.16 163.38 27.77 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.099 177.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.708 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 109.84 179.77 20.83 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.181 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.11 123.41 87.22 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-O 120.352 0.12 . . . . 0.0 110.797 -179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -53.41 -46.05 36.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.327 2.685 . . . . 0.0 113.234 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.1 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.822 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 100' ' ' PRO . 14.0 tp -59.82 -43.9 94.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.845 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.747 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 92.7 m -64.62 -37.74 88.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.828 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 71' ' ' LEU . 2.4 tt0 -63.07 -40.77 98.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.868 0.366 . . . . 0.0 110.896 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.31 -45.61 92.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.429 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.46 -31.27 70.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.424 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 23.1 mt -55.7 -52.26 64.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.124 0.488 . . . . 0.0 111.328 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -76.86 -36.69 56.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.986 -177.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.544 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -64.05 -46.65 83.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.734 -178.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.33 90.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.708 0.29 . . . . 0.0 111.58 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -71.31 -26.95 63.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.446 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.6 OUTLIER -92.95 -2.42 55.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.739 178.401 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.501 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -90.9 156.99 17.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.282 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -97.5 101.2 12.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.071 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -88.54 115.59 63.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.795 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.31 130.76 35.36 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.537 2.158 . . . . 0.0 112.024 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -59.92 121.16 56.34 Favored Pre-proline 0 N--CA 1.445 -0.713 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.891 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.429 ' CB ' ' HB2' ' A' ' 88' ' ' TYR . 47.0 Cg_exo -39.17 104.62 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 124.307 3.338 . . . . 0.0 114.492 -173.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -83.58 -52.2 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.895 2.397 . . . . 0.0 111.843 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.66 126.46 31.04 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -66.47 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.167 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.34 -43.22 86.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 174.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.618 HG13 ' HD2' ' A' ' 91' ' ' PHE . 1.8 t -62.48 -42.54 96.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.606 175.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.429 ' HB2' ' CB ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -60.87 -44.51 96.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.001 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.869 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -70.78 -21.24 62.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -175.797 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.4 t -92.53 -55.0 6.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.699 0.285 . . . . 0.0 111.245 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.618 ' HD2' HG13 ' A' ' 87' ' ' VAL . 12.9 m-85 -67.48 -14.95 63.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -173.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.869 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 3.4 pttp -70.31 -6.01 32.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.018 0.437 . . . . 0.0 110.679 177.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -164.93 67.69 0.14 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.103 173.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -136.24 97.85 11.76 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.866 -176.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.725 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 13.2 Cg_exo -72.02 112.6 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.466 2.111 . . . . 0.0 110.262 178.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.455 HD11 ' HE1' ' A' ' 91' ' ' PHE . 11.8 mt -88.54 149.15 23.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.993 -168.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.61 126.51 34.55 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.585 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.71 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 19.4 t80 -98.54 102.8 14.65 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.1 0.476 . . . . 0.0 109.824 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -109.86 100.09 41.45 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 174.861 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.465 ' HG3' HD21 ' A' ' 66' ' ' LEU . 2.6 Cg_endo . . . . . 0 N--CA 1.461 -0.385 0 C-N-CA 123.334 2.689 . . . . 0.0 113.191 -170.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 95.8 mt . . . . . 0 CA--C 1.531 0.221 0 CA-C-O 120.726 0.298 . . . . 0.0 111.416 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -65.8 -41.73 91.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.167 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -62.5 -46.06 90.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.467 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.432 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -62.06 -48.11 81.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.772 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -63.66 -29.94 71.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.105 0.478 . . . . 0.0 110.862 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.35 -51.84 20.03 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.524 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 3.6 pt20 -66.12 -26.59 67.52 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.719 HG12 HD12 ' A' ' 79' ' ' ILE . 52.5 mt -64.08 -40.54 89.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 20' ' ' ALA . 3.6 mttp -63.93 -42.07 97.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.298 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 m -62.95 -47.18 84.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.942 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.78 -44.59 77.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.282 0.563 . . . . 0.0 110.545 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.2 mt -61.88 -42.0 92.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.378 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.494 ' C ' ' H ' ' A' ' 30' ' ' LYS . 4.0 tm-20 -76.39 -27.7 56.46 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.254 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.3 m -76.9 24.48 0.16 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.561 0.696 . . . . 0.0 110.72 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -133.34 -33.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.739 177.725 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.452 ' HE2' ' HB1' ' A' ' 69' ' ' ALA . 1.0 OUTLIER . . . . . 0 CA--C 1.534 0.362 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.59 -176.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.37 134.73 31.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.14 92.32 3.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.099 0.476 . . . . 0.0 110.684 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.487 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -67.04 118.23 10.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.0 mt -108.42 118.46 36.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.755 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.3 mtt180 -82.26 89.57 6.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.784 177.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.31 148.13 6.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.795 -173.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.562 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 11.1 mttt -130.18 103.71 6.89 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.988 176.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.24 145.84 25.14 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.086 0.47 . . . . 0.0 111.701 -174.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -96.54 160.9 28.46 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.864 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 27.4 Cg_endo -63.88 0.81 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.035 2.49 . . . . 0.0 113.319 -178.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -104.12 -2.39 25.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.014 0.435 . . . . 0.0 110.555 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.491 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 97.31 -23.66 34.83 Favored Glycine 0 C--O 1.226 -0.354 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.585 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.9 ptm -73.31 148.98 43.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.746 0.308 . . . . 0.0 110.446 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -85.8 124.79 32.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.808 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.88 -14.7 33.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.167 0.508 . . . . 0.0 109.947 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.562 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 42.4 t0 -160.44 140.08 11.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.919 178.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 5.7 tt -159.25 113.32 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 120.971 0.415 . . . . 0.0 110.321 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HB3' ' HE3' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -141.46 142.08 25.18 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.725 -178.488 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.531 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 14.7 Cg_exo -69.72 128.98 16.84 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.477 ' HB3' ' HB ' ' A' ' 43' ' ' THR . 22.8 tt0 -83.19 -57.91 3.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.575 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -156.07 144.46 10.9 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.58 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 158.53 -133.42 3.43 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.384 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -113.52 125.32 29.76 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.84 -43.88 52.74 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.98 2.454 . . . . 0.0 112.82 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.81 -52.01 42.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.126 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.4 HD21 ' HD3' ' A' ' 100' ' ' PRO . 23.1 tp -57.43 -47.3 82.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.968 0.413 . . . . 0.0 110.97 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.2 m -63.61 -42.71 98.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.06 -178.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -63.15 -41.01 99.19 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.814 0.34 . . . . 0.0 110.819 179.033 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.452 ' HB1' ' HE2' ' A' ' 31' ' ' PHE . . . -65.7 -42.33 91.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.564 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.53 -37.6 81.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.113 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.759 HD12 ' HA ' ' A' ' 68' ' ' GLN . 24.9 mt -59.82 -50.14 74.96 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.587 178.05 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.13 97.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.168 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.38 81.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.212 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.75 -27.78 69.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.292 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt -69.32 -34.6 74.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.626 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.492 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -85.95 -28.49 24.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -178.976 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 126.94 31.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.1 mtpt -94.85 107.27 19.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.876 -177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.719 HD12 HG12 ' A' ' 23' ' ' ILE . 6.9 mm -81.42 128.22 70.71 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.062 177.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 17.9 Cg_exo -64.93 132.35 31.98 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.747 2.298 . . . . 0.0 111.01 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.485 ' HB3' ' HE2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -53.11 128.04 47.54 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.011 -177.094 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 20.4 Cg_endo -64.49 121.32 8.87 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.782 2.321 . . . . 0.0 112.001 -176.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 6.6 Cg_endo -83.91 -69.06 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.926 2.417 . . . . 0.0 112.53 -176.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.22 134.07 55.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.233 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.41 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 2.1 mt-30 -55.12 -40.42 70.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.726 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.46 -50.97 71.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.951 0.405 . . . . 0.0 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.1 -42.02 95.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.973 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -65.26 -36.01 82.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.395 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 19.8 mm-40 -76.48 -40.29 50.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.0 110.549 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.2 t -64.33 -46.03 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.177 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -76.99 -6.19 51.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.667 -177.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 8.2 mttt -61.32 -23.72 65.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.023 0.44 . . . . 0.0 110.258 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.48 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 35.0 t30 -158.11 74.82 0.73 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.968 174.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -116.86 81.95 12.63 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.084 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.755 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.7 Cg_exo -73.41 104.83 1.87 Allowed 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.751 2.3 . . . . 0.0 111.192 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.6 146.34 23.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.204 -174.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.487 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -79.18 94.15 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.943 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.447 ' HZ ' HG22 ' A' ' 23' ' ' ILE . 1.1 m-85 -86.14 103.2 14.57 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.628 0.727 . . . . 0.0 110.894 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -109.92 158.21 35.6 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.46 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.4 ' HD3' HD21 ' A' ' 66' ' ' LEU . 79.0 Cg_exo . . . . . 0 C--N 1.348 0.536 0 C-N-CA 122.685 2.257 . . . . 0.0 111.582 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.504 HD13 HG23 ' A' ' 87' ' ' VAL . 24.6 mm . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.96 0.41 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -44.07 95.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.099 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.435 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 4.5 t-20 -68.45 -32.89 73.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.09 -48.19 45.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.739 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB2' ' HZ ' ' A' ' 91' ' ' PHE . . . -58.2 -49.05 78.41 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.162 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -61.7 -43.02 99.81 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.344 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -60.87 -32.52 71.95 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.655 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.419 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 52.6 mt -67.68 -42.41 86.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.852 0.358 . . . . 0.0 110.362 178.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.81 -40.3 95.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.716 176.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.586 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 12.4 m -64.8 -41.98 95.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.97 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -56.37 -50.42 71.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.5 mt -63.46 -43.85 98.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.5 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.586 ' OE1' ' HA ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -65.61 -26.38 67.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.792 0.33 . . . . 0.0 111.069 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.3 m -76.44 -1.93 29.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.752 0.31 . . . . 0.0 111.093 177.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 6.2 mmtt -115.17 2.14 14.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 0.0 110.636 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.534 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.737 0.303 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.81 HG23 ' HG3' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -122.66 162.14 22.5 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.208 177.633 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.677 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 43.2 t -146.79 142.01 27.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.548 -178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.98 104.27 7.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.517 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.42 125.48 51.03 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.913 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.967 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.4 OUTLIER -74.05 127.81 33.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 173.976 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.478 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.1 pt -129.26 142.3 44.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.073 0.464 . . . . 0.0 110.217 -178.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HB2' ' CB ' ' A' ' 56' ' ' ASP . 7.7 mtpt -133.02 115.29 14.98 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 48' ' ' LEU . 9.1 mt -79.9 130.2 35.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.129 0.49 . . . . 0.0 111.574 -173.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.34 158.61 43.25 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.9 176.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -59.75 -13.61 22.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.965 2.444 . . . . 0.0 113.361 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -98.79 -6.41 29.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.374 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.452 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 110.88 -19.8 25.08 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.29 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.36 158.66 27.39 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.921 0.36 . . . . 0.0 111.059 -178.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -88.98 106.94 18.75 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 175.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 pp -72.82 -31.88 65.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.304 -178.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.479 ' CB ' ' HB2' ' A' ' 47' ' ' LYS . 0.4 OUTLIER -118.74 124.8 48.17 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.718 176.941 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.505 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.1 tp -148.56 106.72 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.246 0.546 . . . . 0.0 109.648 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -147.86 128.45 6.89 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.96 -172.787 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.665 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 12.6 Cg_exo -70.26 92.7 0.56 Allowed 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.098 2.532 . . . . 0.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.33 -45.8 75.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.484 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -141.82 -179.12 18.61 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.504 -0.638 . . . . 0.0 111.504 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.677 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 102.32 -178.15 26.45 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.64 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.95 121.92 83.3 Favored Pre-proline 0 C--N 1.327 -0.399 0 C-N-CA 122.415 0.286 . . . . 0.0 110.49 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.82 -43.48 54.15 Favored 'Trans proline' 0 CA--C 1.528 0.216 0 C-N-CA 122.79 2.327 . . . . 0.0 112.74 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.19 -38.95 92.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.853 0.359 . . . . 0.0 111.17 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -71.49 -45.98 61.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.665 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 68.8 m -65.92 -38.99 90.15 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.703 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -64.55 -37.23 86.82 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.819 0.342 . . . . 0.0 110.455 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.07 -37.22 72.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.384 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.99 -27.91 69.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.004 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.5 mt -61.1 -45.31 95.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 110.365 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.25 86.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.621 178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.45 -44.14 92.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.341 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.99 70.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -74.83 -25.98 59.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.339 177.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.0 -13.43 50.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.316 0.579 . . . . 0.0 110.296 177.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -86.28 149.23 25.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.096 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -125.86 91.37 3.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.851 0.357 . . . . 0.0 110.075 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 52' ' ' GLY . 29.2 mm -66.24 127.84 93.49 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.656 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -67.48 153.64 76.0 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.57 2.18 . . . . 0.0 112.263 -175.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.23 122.14 73.7 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.925 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 50.3 Cg_exo -41.34 118.45 0.77 Allowed 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 123.835 3.023 . . . . 0.0 113.879 -174.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 3.1 Cg_endo -79.38 -75.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 123.109 2.539 . . . . 0.0 111.38 177.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.8 124.98 27.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.895 175.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -64.01 -26.97 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.58 0.229 . . . . 0.0 111.021 -177.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.02 -25.9 68.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.204 0.526 . . . . 0.0 110.969 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.504 HG23 HD13 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -77.65 -30.65 16.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.795 178.767 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -78.6 -38.0 41.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.271 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 25.7 pt-20 -67.76 -18.67 64.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.87 0.367 . . . . 0.0 110.877 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -92.07 -49.54 13.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.681 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.565 ' HZ ' ' HB2' ' A' ' 20' ' ' ALA . 22.4 m-85 -87.81 26.24 1.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.1 ttmt -73.08 -31.07 64.13 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.082 0.468 . . . . 0.0 110.27 177.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.447 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 12.5 p-10 -151.87 38.47 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.106 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -102.85 103.63 34.46 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.967 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.9 Cg_exo -72.25 155.11 56.53 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.886 2.391 . . . . 0.0 112.037 -174.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.471 HD22 ' HA ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -99.19 132.44 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.294 -172.665 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -92.19 120.07 32.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.98 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -117.02 142.49 46.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.382 0.611 . . . . 0.0 111.723 -172.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.81 ' HG3' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -145.18 143.56 20.79 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.532 174.226 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo . . . . . 0 C--N 1.344 0.338 0 C-N-CA 122.665 2.243 . . . . 0.0 111.737 -178.482 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.416 HG23 HG13 ' A' ' 87' ' ' VAL . 1.7 mt . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.134 0.492 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -66.17 -32.02 73.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.681 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -62.17 -43.84 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 177.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.483 ' O ' HG13 ' A' ' 23' ' ' ILE . 11.3 t80 -62.54 -48.36 79.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 177.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.63 -45.64 85.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 111.293 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.36 -35.9 90.87 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.489 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -66.97 -38.96 87.03 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.465 0.172 . . . . 0.0 111.465 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 19' ' ' TYR . 14.1 mt -63.17 -43.14 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.436 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -62.81 -40.19 96.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.722 177.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.2 m -70.26 -34.24 72.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.924 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.637 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -61.09 -40.57 94.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.007 0.432 . . . . 0.0 110.752 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.474 HG23 ' HB3' ' A' ' 73' ' ' ALA . 37.7 mt -66.18 -37.91 80.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.641 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.98 -20.79 60.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.905 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -74.24 -7.94 54.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.215 0.531 . . . . 0.0 110.7 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.644 ' HD2' ' HB2' ' A' ' 76' ' ' LEU . 2.5 mmtm -114.21 -27.16 7.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.034 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.41 174.756 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.774 0.321 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.525 HG23 ' HB2' ' A' ' 99' ' ' LYS . 1.0 OUTLIER -131.87 153.12 50.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.103 176.218 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 117.32 12.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.879 0.371 . . . . 0.0 110.959 -178.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 m -84.9 104.8 15.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.789 0.328 . . . . 0.0 110.465 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.0 mt -93.49 114.0 26.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.239 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.619 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.6 ttm180 -74.52 96.16 2.89 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.2 pt -117.59 113.78 43.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.382 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.525 ' HG2' HD21 ' A' ' 55' ' ' LEU . 3.2 tttt -97.91 111.72 23.92 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.548 HD13 ' HD2' ' A' ' 91' ' ' PHE . 2.2 mt -94.8 124.86 39.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.0 0.428 . . . . 0.0 110.888 -174.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.61 152.92 95.23 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.011 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.08 -20.17 44.57 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.177 2.584 . . . . 0.0 113.472 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -83.82 -4.03 58.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.699 0.285 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.81 44.45 4.83 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.608 176.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.431 ' O ' ' HG3' ' A' ' 53' ' ' MET . 0.0 OUTLIER -139.39 142.39 37.53 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 177.221 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.83 96.83 7.12 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.777 0.322 . . . . 0.0 110.151 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.525 HD21 ' HG2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -73.01 -35.17 66.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.023 0.44 . . . . 0.0 110.14 -178.71 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.446 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 34.3 t0 -126.62 101.84 6.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.217 177.387 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 tt -127.99 111.36 24.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.06 0.457 . . . . 0.0 110.294 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -153.79 141.8 13.94 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 -177.821 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.443 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 20.6 Cg_exo -64.8 124.68 13.52 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.459 2.106 . . . . 0.0 111.865 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.15 -54.57 4.93 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -162.07 144.61 9.87 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 177.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 157.32 -130.03 2.53 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.501 -178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.6 121.59 25.79 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.551 0.215 . . . . 0.0 110.56 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -46.72 -45.0 20.98 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 123.596 2.864 . . . . 0.0 113.431 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.59 -52.11 65.75 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.716 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.455 ' HG ' ' CE2' ' A' ' 98' ' ' PHE . 9.2 tp -66.22 -42.64 88.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 4.0 m -63.51 -42.19 98.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.595 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -65.87 -39.8 91.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.07 91.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.291 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . . . -67.32 -46.31 73.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.723 176.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.411 HD11 ' HD3' ' A' ' 59' ' ' PRO . 1.4 mt -55.06 -46.09 75.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.012 0.434 . . . . 0.0 111.026 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.85 88.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.728 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.474 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -81.98 -41.57 20.58 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -176.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.67 -32.96 72.14 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.63 61.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.169 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.644 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 1.9 mt -90.62 -25.43 20.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 110.566 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.637 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -64.44 138.64 58.52 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.636 -174.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 81.1 2.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.331 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.478 HG12 HG23 ' A' ' 23' ' ' ILE . 2.3 mp -71.44 126.17 91.76 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.552 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.7 Cg_exo -66.8 177.66 3.34 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 123.08 2.52 . . . . 0.0 112.007 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 142.92 31.09 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.271 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.448 ' HA ' ' HD2' ' A' ' 83' ' ' PRO . 6.5 Cg_endo -48.68 118.27 3.28 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.401 2.734 . . . . 0.0 112.223 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' A' ' 82' ' ' PRO . 18.2 Cg_endo -63.57 -29.01 70.12 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.089 2.526 . . . . 0.0 113.313 -175.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.22 159.48 40.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.853 0.358 . . . . 0.0 111.278 -177.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -62.76 -34.75 77.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.12 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.19 -37.9 81.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.416 HG13 HG23 ' A' ' 16' ' ' ILE . 2.2 t -74.63 -26.87 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.866 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.3 OUTLIER -61.59 -37.94 85.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.498 178.23 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -72.44 -35.33 68.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.2 t -70.38 -54.54 18.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.579 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.548 ' HD2' HD13 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -71.01 9.23 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -174.628 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.504 ' HD2' ' O ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -75.04 -25.4 58.68 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.111 -0.368 . . . . 0.0 111.227 177.444 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -173.74 34.64 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.667 0.27 . . . . 0.0 111.628 -177.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -102.54 113.05 66.08 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 120.823 0.344 . . . . 0.0 110.691 176.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.619 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 20.1 Cg_exo -72.83 144.72 39.41 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.052 2.501 . . . . 0.0 111.542 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.471 ' HA ' HD23 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -91.69 142.87 27.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -174.869 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.83 97.19 9.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.454 173.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.46 ' CE2' ' HB2' ' A' ' 70' ' ' ALA . 57.6 t80 -79.3 107.4 12.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.454 0.645 . . . . 0.0 110.596 -177.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.596 ' HG2' ' HD2' ' A' ' 100' ' ' PRO . 5.3 ttpt -150.03 148.89 26.09 Favored Pre-proline 0 C--N 1.311 -1.086 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.596 ' HD2' ' HG2' ' A' ' 99' ' ' LYS . 23.8 Cg_exo . . . . . 0 C--N 1.353 0.774 0 C-N-CA 124.202 3.268 . . . . 0.0 112.564 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.0 mt . . . . . 0 N--CA 1.457 -0.078 0 CA-C-O 120.959 0.409 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -60.48 -33.21 72.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.862 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.465 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 17.4 t-20 -74.69 -47.77 29.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.687 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -68.27 -37.73 81.01 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.205 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.94 -27.19 64.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.432 0.634 . . . . 0.0 109.459 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.73 -27.86 73.57 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.052 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 18' ' ' ASN . 50.8 mm-40 -63.4 -33.31 75.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.049 0.452 . . . . 0.0 109.966 176.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.432 HD12 HG23 ' A' ' 79' ' ' ILE . 7.8 mm -77.26 -42.27 30.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.656 176.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.459 ' NZ ' ' HB3' ' A' ' 24' ' ' LYS . 4.7 mtpm? -58.88 -53.85 53.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.338 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -59.75 -33.08 71.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.657 0.265 . . . . 0.0 111.292 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.3 -50.13 71.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.637 HG23 ' HB1' ' A' ' 73' ' ' ALA . 74.7 mt -68.3 -32.62 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.206 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -20.66 66.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.951 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.44 14.86 28.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 177.411 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.422 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -148.89 33.3 0.76 Allowed 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.14 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.3 p90 . . . . . 0 N--CA 1.433 -1.307 0 CA-C-N 113.756 -1.566 . . . . 0.0 112.676 -167.993 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.54 ' O ' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.228 -0.078 0 CA-C-O 120.537 0.208 . . . . 0.0 110.572 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.448 ' HA ' ' HB3' ' A' ' 99' ' ' LYS . 23.7 m -153.95 115.83 4.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.56 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.5 OUTLIER -121.16 177.97 4.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.147 -178.571 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.8 m -148.89 122.24 9.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.202 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.491 HD11 ' HB1' ' A' ' 70' ' ' ALA . 18.8 mt -94.23 113.55 25.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.569 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.691 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 tmm_? -78.15 89.44 4.25 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 175.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -102.37 136.67 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.051 -173.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.61 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -114.63 100.15 8.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.319 177.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 tp -86.34 126.41 34.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.202 -174.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.658 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -76.92 167.74 34.12 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.246 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.658 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 6.7 Cg_endo -52.66 -37.96 75.71 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.162 2.575 . . . . 0.0 113.657 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -74.01 -10.7 59.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.948 0.404 . . . . 0.0 111.406 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 97.73 11.58 50.03 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.032 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ptm -98.94 146.71 25.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.472 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -77.48 109.59 11.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.77 0.319 . . . . 0.0 110.306 -179.09 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.61 -21.23 30.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.374 0.607 . . . . 0.0 109.893 178.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.61 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 48.1 t0 -149.3 135.55 19.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.106 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.7 tt -153.89 113.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.221 0.534 . . . . 0.0 110.372 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.6 tttp -151.85 132.61 7.54 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.084 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.53 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 50.8 Cg_exo -55.44 125.41 19.05 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.713 2.275 . . . . 0.0 112.214 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -77.31 -53.53 7.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.965 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -174.39 151.76 13.3 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.038 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.56 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 149.88 -101.67 0.22 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.808 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.576 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 12.6 t70 -141.42 129.44 12.06 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 -178.202 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -56.33 -40.65 83.3 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.362 2.708 . . . . 0.0 113.432 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.07 -38.3 63.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.928 0.394 . . . . 0.0 110.984 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -66.58 -50.21 63.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.551 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.654 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.3 m -69.45 -21.91 63.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.509 -177.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -67.74 -50.55 56.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.15 -31.47 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.377 177.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.491 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -56.44 -46.19 80.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.45 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 6.4 mt -62.69 -41.31 99.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.893 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.04 -44.89 79.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.018 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.637 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.91 -43.01 94.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.03 -24.56 66.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 0.0 110.952 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 -28.49 46.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.565 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.422 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -86.99 -20.14 27.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.884 -178.074 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -92.59 149.75 21.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.498 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 pttp -105.73 135.41 47.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.422 0.63 . . . . 0.0 111.051 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.432 HG23 HD12 ' A' ' 23' ' ' ILE . 3.5 mp -110.09 130.84 22.4 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.288 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -84.67 164.47 12.2 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.143 1.895 . . . . 0.0 112.21 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 ttmm -70.88 126.87 92.19 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.933 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.488 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 52.4 Cg_exo -54.66 117.73 4.31 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.947 2.432 . . . . 0.0 112.048 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -70.31 -62.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.571 2.181 . . . . 0.0 112.832 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.65 138.81 32.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.748 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.516 ' HA ' ' HB3' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -61.05 -30.79 70.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 0.0 111.046 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.09 -52.76 63.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 177.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -69.12 -35.51 68.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.046 0.45 . . . . 0.0 110.404 178.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.516 ' HB3' ' HA ' ' A' ' 85' ' ' GLN . 0.9 OUTLIER -56.39 -43.87 79.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.873 179.682 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 33.7 mt-10 -75.61 -35.01 60.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.171 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.3 t -64.98 -43.16 96.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.106 0.479 . . . . 0.0 109.885 178.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -83.69 41.83 0.81 Allowed 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.077 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 1.1 tpmp? -101.82 -23.98 14.11 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.121 0.486 . . . . 0.0 109.738 175.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -158.98 59.89 0.42 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.052 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.12 95.78 49.16 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.595 -176.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.691 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.1 Cg_exo -72.96 137.72 27.18 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 123.012 2.474 . . . . 0.0 111.511 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.38 153.66 17.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.77 133.49 40.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.191 173.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.439 ' CZ ' HG21 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -131.82 103.06 6.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.519 0.676 . . . . 0.0 111.25 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.625 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.3 OUTLIER -139.95 167.6 17.78 Favored Pre-proline 0 C--N 1.315 -0.912 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.389 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.625 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 9.5 Cg_endo . . . . . 0 C--N 1.353 0.803 0 C-N-CA 123.059 2.506 . . . . 0.0 110.626 175.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.478 ' HA ' HG23 ' A' ' 87' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.968 0.413 . . . . 0.0 110.835 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -60.5 -26.73 67.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.864 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.32 -52.53 53.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.654 0.264 . . . . 0.0 110.56 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.559 ' CE2' HD11 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -64.03 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.583 178.109 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . -64.28 -39.85 94.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.233 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.52 -33.46 87.31 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.733 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.89 -38.77 86.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.587 0.232 . . . . 0.0 111.214 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.559 HD11 ' CE2' ' A' ' 19' ' ' TYR . 5.8 mt -62.51 -36.03 72.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.003 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 20' ' ' ALA . 3.6 mmtp -58.46 -50.18 74.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.147 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.51 -32.74 58.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.539 -178.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.489 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.89 -47.94 83.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.14 0.495 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.419 HG23 ' CB ' ' A' ' 73' ' ' ALA . 84.1 mt -73.92 -31.39 30.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.804 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -29.38 70.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.912 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.97 -8.54 59.0 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.987 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.49 36.34 4.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.79 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.0 p90 . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 121.482 0.658 . . . . 0.0 110.956 -178.984 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mmtp . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.849 0.357 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.39 162.37 22.9 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.205 175.297 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.71 107.1 1.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.712 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.2 m -87.59 135.01 33.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.786 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -127.0 126.73 43.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.82 0.343 . . . . 0.0 110.692 -179.033 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.784 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 2.7 ttm-85 -80.61 97.92 7.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.715 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 46' ' ' ILE . 1.6 pt -105.91 149.07 9.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.33 0.586 . . . . 0.0 111.528 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.573 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 22.1 mttp -127.1 109.4 11.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.932 177.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -95.39 150.14 20.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.395 0.617 . . . . 0.0 111.694 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.512 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -111.58 161.06 27.14 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.366 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.493 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.1 Cg_endo -60.05 -17.07 43.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.23 2.62 . . . . 0.0 113.169 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.9 0.43 51.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.791 0.329 . . . . 0.0 111.125 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.62 29.54 52.02 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.869 177.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -132.88 143.98 49.87 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.446 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -89.49 112.48 23.66 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.846 0.355 . . . . 0.0 110.352 -178.887 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.512 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.0 OUTLIER -74.4 -30.87 62.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.224 -179.532 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.573 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.8 t70 -133.32 139.52 46.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.176 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.428 HG12 HD22 ' A' ' 71' ' ' LEU . 5.6 tt -155.78 106.78 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.293 0.568 . . . . 0.0 109.652 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -124.03 133.75 24.89 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.133 -172.492 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 24.7 Cg_exo -60.47 125.52 17.59 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.461 2.107 . . . . 0.0 111.613 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' ' HB2' ' A' ' 45' ' ' ARG . 9.4 mm-40 -87.66 -68.57 0.75 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.703 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.75 133.74 4.31 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.272 -0.877 . . . . 0.0 111.291 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 154.45 -159.16 28.71 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.176 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 66' ' ' LEU . 12.0 t70 -78.18 125.87 84.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.469 0.176 . . . . 0.0 110.76 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 53.3 Cg_exo -53.6 -37.32 83.09 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.923 2.415 . . . . 0.0 112.82 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.09 -43.58 42.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.213 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.406 ' HB3' ' HB3' ' A' ' 63' ' ' ASP . 37.1 tp -65.99 -47.09 75.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.884 0.373 . . . . 0.0 110.388 179.274 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.577 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.3 m -62.58 -44.63 95.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.492 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 1.2 tp60 -61.16 -41.51 96.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.907 178.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.53 -31.56 72.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.022 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.83 -44.93 68.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 0.1 OUTLIER -62.31 -41.92 98.94 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.836 0.35 . . . . 0.0 110.576 178.696 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -46.57 87.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.957 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.419 ' CB ' HG23 ' A' ' 27' ' ' ILE . . . -65.15 -43.43 91.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.545 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.36 75.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.36 -26.08 55.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.712 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.05 -33.14 33.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.409 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.489 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -81.93 166.95 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.028 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.22 115.39 26.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.1 178.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 28.5 mm -87.31 125.63 65.14 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.959 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.55 124.86 17.28 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.414 2.076 . . . . 0.0 111.715 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.524 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -55.86 145.48 52.57 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.665 -178.386 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.43 ' HG3' ' HZ ' ' A' ' 91' ' ' PHE . 12.4 Cg_exo -34.64 99.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 125.129 3.886 . . . . 0.0 114.774 -175.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -79.07 -37.52 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.529 2.153 . . . . 0.0 111.251 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.503 ' O ' HG12 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -99.42 146.69 26.05 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.012 177.235 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -76.83 -40.08 49.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 111.074 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.9 -27.59 64.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.924 0.393 . . . . 0.0 111.249 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.503 HG12 ' O ' ' A' ' 84' ' ' SER . 0.5 OUTLIER -71.0 -23.7 23.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.618 -178.208 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.519 ' HA ' ' CZ ' ' A' ' 91' ' ' PHE . 89.6 t80 -65.4 -34.03 77.35 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.103 0.477 . . . . 0.0 110.467 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.53 -18.35 60.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.563 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 52.5 t -85.93 -53.4 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.938 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.519 ' CZ ' ' HA ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -81.25 9.87 6.36 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -173.182 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -61.61 -30.18 70.52 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.573 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 10.8 t30 -160.09 72.53 0.5 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.529 -1.214 . . . . 0.0 108.643 171.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.425 ' CB ' ' HA ' ' A' ' 91' ' ' PHE . . . -113.17 84.58 7.38 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.943 -175.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.784 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 21.2 Cg_exo -73.46 110.78 3.14 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.065 2.51 . . . . 0.0 111.71 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.63 151.7 19.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.823 -175.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.712 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 29.2 t70 -103.76 100.94 10.77 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 176.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.53 135.06 33.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.227 0.536 . . . . 0.0 111.251 -176.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.26 144.01 49.17 Favored Pre-proline 0 C--N 1.323 -0.584 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.701 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_exo . . . . . 0 N--CA 1.475 0.419 0 C-N-CA 124.061 3.174 . . . . 0.0 112.061 -179.791 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.402 HG23 ' HA ' ' A' ' 87' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.711 0.291 . . . . 0.0 111.234 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -36.91 85.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.076 0.465 . . . . 0.0 110.554 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -69.91 -37.96 76.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.336 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -42.61 99.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.672 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.42 82.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 0.0 111.111 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.26 -33.79 56.04 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.815 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -28.29 69.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.693 0.283 . . . . 0.0 111.432 -176.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.469 ' O ' HG13 ' A' ' 27' ' ' ILE . 4.0 mt -70.76 -35.5 60.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.71 0.291 . . . . 0.0 110.485 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -59.87 -47.62 85.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.74 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -35.54 75.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.886 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -47.71 81.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.397 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 23' ' ' ILE . 53.6 mt -64.59 -36.72 78.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.943 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -64.2 -38.57 91.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 110.962 176.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.1 m -73.15 -10.42 59.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.164 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.749 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.23 -8.79 15.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.2 -178.608 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.361 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 176.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 120.856 0.36 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -127.3 128.35 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.642 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.21 105.25 6.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.093 0.473 . . . . 0.0 111.473 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -89.27 118.25 28.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.435 -179.362 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.61 127.37 54.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.36 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.82 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 1.1 tpp180 -80.1 111.89 16.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.9 pt -120.97 137.58 54.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.285 0.564 . . . . 0.0 110.771 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -122.93 111.07 16.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.354 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.6 tp -94.95 143.67 26.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.17 0.51 . . . . 0.0 111.701 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.633 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -103.39 166.67 11.37 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.542 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.633 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 36.2 Cg_endo -64.17 -11.51 28.04 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.168 1.912 . . . . 0.0 111.782 177.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 81' ' ' LYS . 24.5 t70 -85.52 -13.38 49.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.309 176.306 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.03 -15.39 63.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.349 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.53 149.16 36.73 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.975 0.417 . . . . 0.0 110.607 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.26 105.55 17.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.887 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.424 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.2 OUTLIER -68.25 -30.63 69.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.561 . . . . 0.0 109.85 179.204 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -135.24 131.45 36.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.65 176.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -156.49 105.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.172 0.511 . . . . 0.0 109.656 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 7.0 ptpp? -154.77 148.18 18.48 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.906 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.66 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 10.4 Cg_exo -73.0 129.61 14.44 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.032 2.488 . . . . 0.0 111.663 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.36 -70.56 0.72 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.9 127.34 6.96 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.674 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 164.45 -138.8 5.47 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.592 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.535 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 11.5 t70 -122.78 129.97 24.81 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 53.6 Cg_exo -55.76 -34.4 90.85 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.131 2.554 . . . . 0.0 113.68 -176.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.77 -43.3 18.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.751 0.31 . . . . 0.0 110.76 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.681 HD11 ' HD3' ' A' ' 100' ' ' PRO . 0.2 OUTLIER -58.82 -52.25 66.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.569 178.445 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.66 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 11.9 m -63.06 -36.76 84.65 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.846 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 4.7 tp60 -63.53 -43.24 97.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.72 0.295 . . . . 0.0 110.787 177.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.12 99.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.069 0.461 . . . . 0.0 110.221 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.86 95.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.048 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 66.9 mt -57.56 -49.55 76.02 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.835 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.45 -41.62 94.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.168 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.62 69.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.263 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.03 75.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.842 0.353 . . . . 0.0 111.142 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -68.21 -23.85 64.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.176 0.512 . . . . 0.0 110.891 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.749 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -103.54 3.32 34.59 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.57 179.468 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.45 146.28 45.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.182 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.79 86.25 7.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.87 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.3 109.02 62.73 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.926 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -72.1 159.88 48.83 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.983 2.455 . . . . 0.0 112.762 -174.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 51' ' ' ASP . 2.3 ttmt -69.75 117.55 54.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.499 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 81' ' ' LYS . 32.6 Cg_exo -65.48 109.76 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.764 2.31 . . . . 0.0 112.81 -175.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -82.72 -40.44 0.12 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.468 2.112 . . . . 0.0 111.852 178.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.3 120.37 20.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.309 177.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -65.12 -31.9 73.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.924 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.43 79.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.006 0.432 . . . . 0.0 110.643 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.402 ' HA ' HG23 ' A' ' 16' ' ' ILE . 28.6 t -68.48 -48.98 69.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.544 177.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -37.65 83.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 -179.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.9 mm-40 -71.67 -33.08 68.54 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.622 -178.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.25 -38.0 40.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.193 0.52 . . . . 0.0 110.132 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -79.47 13.7 1.89 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.596 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -70.43 -22.84 62.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.172 175.744 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -161.58 77.84 0.54 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.154 174.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -129.83 80.84 70.6 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.264 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.82 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.4 Cg_exo -73.18 141.24 32.15 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.747 2.298 . . . . 0.0 111.742 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.3 mt -97.96 129.43 44.86 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.291 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.509 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 31.8 t70 -97.85 95.21 7.37 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 172.234 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -104.32 139.49 39.23 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.492 0.663 . . . . 0.0 112.14 -169.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.38 150.1 48.92 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 114.466 -1.243 . . . . 0.0 107.808 171.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.681 ' HD3' HD11 ' A' ' 66' ' ' LEU . 14.5 Cg_endo . . . . . 0 C--N 1.344 0.294 0 C-N-CA 121.915 1.743 . . . . 0.0 110.817 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.437 ' HA ' HG23 ' A' ' 87' ' ' VAL . 6.9 mt . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.843 0.354 . . . . 0.0 110.972 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.88 -37.49 84.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.664 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -70.23 -47.23 62.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.751 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.465 ' CB ' HG21 ' A' ' 87' ' ' VAL . 5.3 t80 -58.44 -49.04 78.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.992 179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.28 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.259 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.81 -49.1 10.84 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.179 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -56.81 -39.28 73.89 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 122.72 0.408 . . . . 0.0 111.658 -177.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.497 HG12 HD12 ' A' ' 79' ' ' ILE . 76.0 mt -57.72 -43.8 84.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.995 0.426 . . . . 0.0 110.61 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.451 ' HA ' ' HZ ' ' A' ' 98' ' ' PHE . 31.8 mttp -65.09 -47.77 76.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.927 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.47 -39.35 79.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.392 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.493 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -66.53 -46.63 75.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.047 0.451 . . . . 0.0 110.677 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.45 HD12 ' CE2' ' A' ' 98' ' ' PHE . 1.7 mt -62.96 -50.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.287 -178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -20.82 66.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.037 -176.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 60.1 m -67.45 -11.84 58.84 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.77 0.319 . . . . 0.0 111.049 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HE2' ' HA ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -113.17 9.81 18.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.091 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 1.9 m-30 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.479 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 120.989 0.423 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.28 168.7 11.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.602 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 4.7 t -152.89 57.64 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.049 0.452 . . . . 0.0 110.522 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.431 HG23 ' HA ' ' A' ' 97' ' ' ASP . 1.8 m -69.36 114.13 7.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.809 0.338 . . . . 0.0 110.219 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.33 124.28 49.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.805 -176.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.576 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -77.63 97.32 5.06 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 174.567 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 95' ' ' PRO . 1.1 pt -121.41 145.54 27.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -174.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HD3' HD11 ' A' ' 55' ' ' LEU . 2.5 tttp -127.94 115.34 18.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.384 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.489 HD13 ' HD2' ' A' ' 91' ' ' PHE . 15.9 mt -94.54 125.02 38.92 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.741 -175.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.468 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -75.26 148.1 83.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.392 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.715 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 2.4 Cg_endo -48.87 -28.4 13.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.899 3.066 . . . . 0.0 113.621 -176.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.46 7.49 9.71 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.32 46.65 9.86 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.378 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.468 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.51 139.12 26.57 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.165 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.63 122.57 24.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.857 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.506 HD11 ' HD3' ' A' ' 47' ' ' LYS . 1.2 pp -93.81 -31.16 14.48 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -129.48 138.44 51.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.634 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.2 tt -159.15 106.9 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.232 0.539 . . . . 0.0 110.101 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -145.43 139.98 15.47 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.904 -175.331 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 14.9 Cg_exo -66.23 120.67 7.84 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.604 2.203 . . . . 0.0 111.196 176.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -102.53 -49.52 3.83 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.421 -175.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -145.9 111.2 0.57 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.278 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 160.3 -161.95 32.92 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.117 -1.04 . . . . 0.0 112.587 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 14.8 t70 -78.75 129.85 72.48 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 120.752 0.311 . . . . 0.0 110.689 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 31.2 Cg_exo -62.25 -34.03 79.34 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.071 2.514 . . . . 0.0 112.929 -176.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -79.62 -41.76 26.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.92 0.391 . . . . 0.0 110.627 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.419 ' CB ' ' HB3' ' A' ' 63' ' ' ASP . 31.2 tp -59.21 -52.88 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.687 178.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 60.3 m -73.22 -15.13 61.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.716 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -72.68 -39.07 67.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.179 0.514 . . . . 0.0 109.873 174.283 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.86 62.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.379 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.402 ' HA ' ' HZ ' ' A' ' 31' ' ' PHE . . . -60.84 -38.01 84.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.198 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 3.0 mt -61.92 -41.41 97.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.139 0.495 . . . . 0.0 110.278 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.71 71.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.809 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.97 91.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.47 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.66 -30.45 71.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.869 0.366 . . . . 0.0 111.343 -178.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -32.79 58.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.352 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -31.69 36.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.681 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.493 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -70.74 157.61 37.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.981 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.29 94.14 4.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.605 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.497 HD12 HG12 ' A' ' 23' ' ' ILE . 33.1 mm -76.33 122.09 86.11 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.803 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.7 153.79 76.62 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.681 2.254 . . . . 0.0 111.675 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.619 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 0.9 OUTLIER -74.53 147.0 84.43 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 175.815 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.619 ' HD2' ' HG2' ' A' ' 81' ' ' LYS . 10.6 Cg_endo -52.96 117.03 3.32 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.928 2.419 . . . . 0.0 111.955 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.465 ' HD2' HG11 ' A' ' 87' ' ' VAL . 5.8 Cg_endo -78.67 -64.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.236 1.958 . . . . 0.0 112.404 -177.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 48.2 m -95.49 159.94 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.153 0.501 . . . . 0.0 111.133 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.9 -27.91 68.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.667 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.35 -50.78 71.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.575 -177.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.465 HG11 ' HD2' ' A' ' 83' ' ' PRO . 4.1 p -74.76 -22.66 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.288 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -62.04 -35.95 80.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.289 0.566 . . . . 0.0 110.657 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.648 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.65 -18.0 55.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.138 -178.944 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.06 -53.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.927 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.715 ' HZ ' ' HA ' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -61.82 -19.03 62.11 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -171.184 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.648 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 8.8 ptpt -73.22 -6.54 46.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.59 -178.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -162.19 50.92 0.2 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.967 0.413 . . . . 0.0 111.15 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -132.84 105.49 12.74 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.228 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.576 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 3.0 Cg_exo -73.77 139.9 28.41 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.707 2.271 . . . . 0.0 110.923 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.56 127.53 35.89 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.066 0.46 . . . . 0.0 111.366 -175.053 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.431 ' HA ' HG23 ' A' ' 43' ' ' THR . 46.6 t0 -93.07 94.35 8.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 173.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.552 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 0.3 OUTLIER -88.18 137.75 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.652 -171.658 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -137.73 112.51 9.06 Favored Pre-proline 0 C--N 1.319 -0.752 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.8 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo . . . . . 0 C--O 1.235 0.333 0 C-N-CA 123.608 2.872 . . . . 0.0 113.752 -173.181 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.564 HG12 HG22 ' A' ' 87' ' ' VAL . 22.9 mt . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 120.908 0.385 . . . . 0.0 110.688 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -59.41 -45.08 92.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.778 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -67.38 -48.57 67.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.938 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.545 ' HD2' ' HG2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -60.52 -34.78 74.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.624 -176.802 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.5 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.99 -40.54 96.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.961 0.41 . . . . 0.0 110.995 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.34 -29.22 62.43 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.891 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -62.67 -37.22 85.55 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 122.148 0.179 . . . . 0.0 111.008 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.5 HD12 ' HA ' ' A' ' 20' ' ' ALA . 12.8 mt -58.39 -44.8 89.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.022 0.439 . . . . 0.0 110.717 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -64.3 -45.42 88.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.084 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -72.45 -31.12 65.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.428 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.39 -45.95 83.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.038 0.447 . . . . 0.0 111.081 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.498 HG23 ' HB1' ' A' ' 73' ' ' ALA . 57.9 mt -60.84 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.123 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -74.25 -21.29 59.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.563 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.8 m -67.53 -17.23 64.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.055 0.455 . . . . 0.0 109.816 175.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.7 -47.97 4.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.496 172.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.512 -179.842 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.29 0 CA-C-O 121.19 0.519 . . . . 0.0 111.684 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.3 152.07 36.47 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.829 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.504 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -163.56 90.33 0.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.156 0.503 . . . . 0.0 110.937 -179.601 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.762 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -70.87 116.88 11.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.409 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.2 mt -99.06 118.13 35.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.712 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.2 ttt180 -80.53 101.14 8.95 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -120.26 137.24 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.36 0.6 . . . . 0.0 111.588 -175.331 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.631 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -129.8 109.23 10.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.107 -0.952 . . . . 0.0 108.605 174.839 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.51 144.07 36.65 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.529 0.681 . . . . 0.0 111.627 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -100.48 161.5 23.8 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.577 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.652 ' HG3' ' HB2' ' A' ' 88' ' ' TYR . 36.4 Cg_exo -57.45 -14.19 15.62 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.041 2.494 . . . . 0.0 112.699 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.22 -11.89 59.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.107 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.2 34.64 23.06 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.886 -179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.47 144.44 47.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.787 0.327 . . . . 0.0 110.238 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.489 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -100.09 97.21 8.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.8 178.917 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -29.8 63.62 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.438 -177.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -129.07 127.09 40.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.319 176.793 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.64 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.0 OUTLIER -159.08 108.77 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.339 -175.925 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -158.0 151.38 18.95 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -72.45 119.81 6.35 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.926 2.417 . . . . 0.0 111.963 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.762 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 74.3 mt-10 -82.37 -65.06 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.143 0.496 . . . . 0.0 109.766 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -143.77 123.6 2.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.384 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.504 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 173.84 -178.02 45.89 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.375 -0.917 . . . . 0.0 112.795 -178.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.34 129.63 90.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.37 -47.82 25.3 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.939 2.426 . . . . 0.0 112.649 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.26 -46.88 75.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.192 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.96 -55.31 36.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.122 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.657 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.8 m -63.3 -31.74 72.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.045 -177.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -63.83 -46.34 85.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.77 0.319 . . . . 0.0 110.592 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.19 -34.2 74.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.534 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.3 78.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.227 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 51.8 mt -59.96 -44.43 94.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.101 0.477 . . . . 0.0 110.56 178.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.75 73.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.827 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.11 -45.34 89.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.75 -178.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.14 -35.34 80.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.906 0.384 . . . . 0.0 111.155 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -68.57 -32.84 73.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.545 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.3 mp -80.48 -32.04 37.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.856 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.11 130.37 43.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.659 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -88.38 84.68 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.503 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.423 HG21 ' HE2' ' A' ' 91' ' ' PHE . 3.0 mt -70.84 132.18 87.07 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.602 -179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.545 ' HG2' ' HD2' ' A' ' 19' ' ' TYR . 18.9 Cg_endo -61.83 125.26 16.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.747 2.298 . . . . 0.0 112.083 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.5 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -75.33 132.39 76.19 Favored Pre-proline 0 N--CA 1.443 -0.798 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.417 -178.832 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 60.7 Cg_exo -52.92 115.71 2.44 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.959 2.44 . . . . 0.0 112.712 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 4.6 Cg_endo -81.14 -69.51 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.95 2.434 . . . . 0.0 111.214 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.67 146.65 49.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.596 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.23 -26.76 68.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.855 0.36 . . . . 0.0 111.446 -175.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.07 -27.44 69.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.108 178.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.564 HG22 HG12 ' A' ' 16' ' ' ILE . 13.6 t -77.26 -32.2 18.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.652 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -61.92 -35.5 78.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.06 0.457 . . . . 0.0 110.225 178.936 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.517 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -67.74 -27.17 66.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.171 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.3 t -68.24 -57.32 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.442 ' HD1' ' HB3' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -85.5 3.35 40.79 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -176.554 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.517 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -63.82 -23.94 67.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.915 0.388 . . . . 0.0 110.411 178.469 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -163.62 78.22 0.41 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.749 174.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.442 ' HB3' ' HD1' ' A' ' 91' ' ' PHE . . . -135.47 84.25 34.96 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.144 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.712 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 4.3 Cg_exo -74.4 104.68 1.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.786 2.324 . . . . 0.0 110.629 177.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.82 140.67 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.21 -174.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 4.8 t70 -87.45 112.35 22.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.845 177.211 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -86.81 111.37 20.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.076 0.465 . . . . 0.0 110.595 -177.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 100' ' ' PRO . 4.6 mtmm -105.02 138.58 19.55 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.555 176.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 99' ' ' LYS . 76.3 Cg_exo . . . . . 0 C--O 1.235 0.339 0 C-N-CA 123.338 2.692 . . . . 0.0 112.951 -177.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.431 ' HA ' ' HD2' ' A' ' 19' ' ' TYR . 7.9 mt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.788 0.327 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -66.07 -32.83 74.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.962 0.41 . . . . 0.0 110.853 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -69.65 -50.22 46.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.681 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.431 ' HD2' ' HA ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -62.87 -34.63 77.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.008 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.55 87.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.062 0.458 . . . . 0.0 110.246 175.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.54 -33.02 75.73 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.234 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -60.69 -36.02 77.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.867 0.365 . . . . 0.0 110.78 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.453 HD12 HG23 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -62.61 -40.72 89.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.41 0.624 . . . . 0.0 109.404 177.837 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 13.1 mttt -66.06 -48.06 72.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.298 178.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 m -54.22 -36.73 63.8 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.798 0.332 . . . . 0.0 111.6 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.85 86.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.011 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -77.18 -42.11 31.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.439 -177.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 59.2 mt-10 -55.33 -38.62 68.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.677 -177.484 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.64 15.34 14.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.886 -176.104 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HD3' ' HB3' ' A' ' 76' ' ' LEU . 67.9 mttt -151.4 33.48 0.57 Allowed 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.8 p90 . . . . . 0 N--CA 1.438 -1.057 0 CA-C-N 113.887 -1.506 . . . . 0.0 113.316 -167.64 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.787 ' HB3' HD22 ' A' ' 66' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.531 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.5 139.01 45.15 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.64 ' HB2' HD23 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -145.87 107.99 4.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.985 0.421 . . . . 0.0 111.151 -176.082 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.4 m -74.97 112.91 11.68 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.2 mt -103.69 122.48 45.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.934 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.568 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -78.63 102.95 8.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.888 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.64 HD11 ' HB2' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -101.29 110.33 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.279 -176.933 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.557 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -101.98 98.39 8.61 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.93 177.814 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -100.04 131.24 46.12 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.269 0.557 . . . . 0.0 111.07 -174.419 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.406 ' HB3' ' HG2' ' A' ' 53' ' ' MET . . . -75.85 153.66 85.01 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.691 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.06 -27.01 34.6 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.186 2.591 . . . . 0.0 113.296 -178.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -77.35 -5.07 48.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.244 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.15 42.21 6.75 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.642 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.406 ' HG2' ' HB3' ' A' ' 49' ' ' ALA . 1.0 OUTLIER -127.82 149.39 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 177.753 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.477 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -81.43 105.64 12.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.39 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.454 ' HG ' ' HB3' ' A' ' 47' ' ' LYS . 1.5 pp -88.19 -24.28 23.34 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.504 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 26.0 t0 -154.68 111.09 3.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.977 179.296 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.418 HD12 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -121.51 106.6 18.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.02 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -133.66 129.12 20.27 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -172.863 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 12.6 Cg_exo -66.68 127.07 16.44 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.557 2.171 . . . . 0.0 110.919 175.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -90.28 -65.77 0.99 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.251 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.67 145.82 13.98 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.639 -0.791 . . . . 0.0 111.72 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 151.82 -136.16 5.35 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.866 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.51 119.21 59.41 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -53.53 -41.16 75.65 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.988 2.459 . . . . 0.0 113.064 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.67 -48.79 53.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.671 0.272 . . . . 0.0 110.933 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.787 HD22 ' HB3' ' A' ' 40' ' ' LYS . 7.8 tp -59.09 -46.39 88.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.699 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.5 m -61.4 -42.03 98.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.266 -177.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -40.2 94.96 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.723 0.296 . . . . 0.0 110.822 179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.05 -38.75 82.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.577 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.23 -36.53 82.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.023 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 45.3 mt -60.63 -45.1 95.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.696 177.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.1 -43.89 90.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.13 -48.71 77.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.115 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.5 -24.45 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.401 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -67.19 -38.13 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.012 0.434 . . . . 0.0 110.426 178.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 76' ' ' LEU . 1.0 OUTLIER -91.69 -17.75 24.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.707 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.27 138.17 58.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.189 -177.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 78' ' ' LYS . 0.4 OUTLIER -82.25 86.36 6.67 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.005 178.638 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.453 HG23 HD12 ' A' ' 23' ' ' ILE . 30.5 mm -82.61 121.02 77.74 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.865 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -82.07 146.78 14.52 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.485 2.124 . . . . 0.0 112.219 -176.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.456 ' HG2' ' H ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -61.64 147.91 87.8 Favored Pre-proline 0 N--CA 1.446 -0.655 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.418 178.597 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.93 112.64 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.653 2.902 . . . . 0.0 113.524 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.53 -26.97 13.48 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.701 2.267 . . . . 0.0 112.284 -177.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.8 152.62 38.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.107 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -63.38 -34.98 78.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.862 -176.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.58 67.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.065 0.46 . . . . 0.0 110.77 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 88.1 t -68.37 -32.2 54.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.096 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.415 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -59.77 -42.11 92.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.986 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.42 ' H ' ' HG2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -79.81 -39.1 31.51 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.044 -0.262 . . . . 0.0 111.488 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.2 t -70.22 -46.46 71.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CD2' HD22 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -63.54 -13.95 46.42 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.586 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 18.1 mtmt -69.13 -5.83 24.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.861 0.362 . . . . 0.0 110.695 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -169.2 69.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -127.51 84.37 63.56 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.529 -174.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.568 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 11.5 Cg_exo -74.24 105.8 2.1 Favored 'Trans proline' 0 CA--C 1.53 0.322 0 C-N-CA 123.158 2.572 . . . . 0.0 111.8 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.64 ' HB2' HD11 ' A' ' 46' ' ' ILE . 2.7 mp -89.57 150.67 22.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.997 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.459 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 1.7 t0 -92.59 97.26 10.7 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -68.37 128.16 35.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.197 0.522 . . . . 0.0 111.418 -175.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.84 112.02 18.79 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.345 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--O 1.233 0.227 0 C-N-CA 123.141 2.56 . . . . 0.0 111.89 -178.557 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 49.5 mm . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.543 0.211 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -57.64 -47.1 83.17 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -65.17 -44.81 87.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.715 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -44.43 96.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.701 178.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.53 95.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.806 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.49 -43.87 97.51 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.981 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.493 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -66.79 -38.52 86.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.535 0.207 . . . . 0.0 111.04 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.493 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 63.6 mt -65.32 -48.55 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.866 0.365 . . . . 0.0 110.576 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -63.37 -24.93 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.142 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 m -78.77 -45.43 21.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.439 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.96 -40.81 73.77 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.238 0.542 . . . . 0.0 110.879 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.631 HG23 ' HB3' ' A' ' 73' ' ' ALA . 5.8 mt -61.69 -46.18 97.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.56 -21.13 63.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.522 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -68.59 -11.76 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.873 0.368 . . . . 0.0 110.664 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.46 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 3.1 mptp? -103.41 -47.07 4.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.028 176.049 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.157 176.898 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.685 ' HB3' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -121.06 107.69 12.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.776 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.604 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.3 OUTLIER -104.95 114.6 28.91 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.978 0.418 . . . . 0.0 111.04 -177.678 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -86.9 99.12 11.62 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.182 176.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.2 mt -85.39 113.03 21.38 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.868 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -74.65 112.67 11.08 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.254 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.572 HG13 ' HA ' ' A' ' 95' ' ' PRO . 1.3 pt -131.88 123.05 50.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.815 -171.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 mtmm -102.68 98.93 8.89 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.898 HD23 ' HD2' ' A' ' 91' ' ' PHE . 4.9 tp -93.62 113.07 25.08 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.045 0.45 . . . . 0.0 110.343 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.64 150.08 87.36 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.226 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.802 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 16.3 Cg_endo -58.28 -6.94 3.3 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 123.206 2.604 . . . . 0.0 113.086 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.91 -4.11 56.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.734 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.4 62.65 2.04 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.54 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.99 139.58 9.95 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.517 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -88.93 104.84 17.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.87 0.367 . . . . 0.0 111.0 -178.065 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.09 -37.94 28.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.155 0.502 . . . . 0.0 109.966 177.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -124.51 121.95 36.26 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.108 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.436 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 4.2 tt -143.35 110.35 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.879 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -140.79 143.39 31.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.356 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.536 ' HG3' HD22 ' A' ' 71' ' ' LEU . 8.8 Cg_exo -70.54 103.73 1.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.246 1.964 . . . . 0.0 111.33 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -70.33 -49.67 47.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.055 0.455 . . . . 0.0 110.025 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -173.71 137.74 4.21 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.843 177.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.604 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 168.61 -102.7 0.19 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.429 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -143.01 128.15 9.97 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -55.48 -37.22 95.14 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.799 2.333 . . . . 0.0 112.907 -177.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.99 -48.95 16.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.685 HD22 ' HB3' ' A' ' 40' ' ' LYS . 34.6 tp -63.33 -45.04 93.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.459 ' O ' HD23 ' A' ' 71' ' ' LEU . 4.1 m -65.39 -43.89 89.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.795 -175.468 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -57.33 -49.81 74.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.742 0.306 . . . . 0.0 110.739 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.66 -29.17 70.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.662 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.16 -51.58 8.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.532 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.536 HD22 ' HG3' ' A' ' 59' ' ' PRO . 0.9 OUTLIER -65.31 -39.22 92.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.318 -176.135 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.566 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . . . -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.1 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.631 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -74.06 -33.45 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.427 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.0 -28.89 68.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 72' ' ' ALA . 8.9 mttm -71.75 -22.78 61.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.071 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -100.95 -19.97 15.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.174 -177.548 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.41 132.94 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.562 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 91.23 8.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.518 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.457 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 38.7 mm -72.22 121.64 85.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.359 179.084 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 29.5 Cg_exo -64.11 153.19 77.64 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.823 2.349 . . . . 0.0 112.042 -177.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 135.25 88.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 116.21 3.03 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.124 2.55 . . . . 0.0 113.179 -173.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -79.64 -50.01 0.07 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.655 2.237 . . . . 0.0 112.157 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.85 156.8 23.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.772 0.32 . . . . 0.0 110.863 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.89 -27.48 57.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.932 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.587 ' O ' HG23 ' A' ' 90' ' ' VAL . . . -60.76 -40.77 93.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.69 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.2 t -61.9 -42.55 95.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 177.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.548 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 0.7 OUTLIER -58.79 -32.26 69.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.524 178.472 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.514 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 2.7 mm-40 -75.91 -30.23 58.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.885 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.616 HG12 ' HB3' ' A' ' 94' ' ' ALA . 5.4 t -92.42 -53.42 8.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -173.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.898 ' HD2' HD23 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -61.72 -13.11 20.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -168.707 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.3 ptpt -75.33 -13.63 60.43 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.952 -177.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -169.21 22.16 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.616 ' HB3' HG12 ' A' ' 90' ' ' VAL . . . -121.38 123.64 27.57 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 121.752 -0.592 . . . . 0.0 111.27 177.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.868 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.3 Cg_exo -72.7 156.78 53.06 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.191 2.594 . . . . 0.0 112.204 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.75 132.79 40.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.419 -175.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 112.64 19.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.305 174.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -106.35 122.78 46.95 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.296 0.569 . . . . 0.0 110.843 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.545 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -150.66 163.32 24.38 Favored Pre-proline 0 C--N 1.312 -1.024 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.499 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.545 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 5.9 Cg_exo . . . . . 0 C--N 1.348 0.529 0 C-N-CA 123.647 2.898 . . . . 0.0 112.324 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.562 ' HA ' HG22 ' A' ' 87' ' ' VAL . 13.9 mt . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.922 0.391 . . . . 0.0 110.365 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -34.05 70.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.112 0.482 . . . . 0.0 109.926 177.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -63.81 -39.74 94.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.881 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.43 -40.34 82.24 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.083 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.86 -49.67 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.266 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.78 -31.58 73.21 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.052 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -34.12 70.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.606 0.241 . . . . 0.0 110.676 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 60.0 mt -66.39 -41.44 88.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.13 83.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.821 176.107 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 m -66.79 -38.14 85.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 0.0 110.569 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.04 -34.95 77.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.214 0.531 . . . . 0.0 110.779 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 5.5 mt -83.32 -56.25 6.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.626 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HA ' ' HB2' ' A' ' 31' ' ' PHE . 43.6 mt-10 -75.48 -22.32 57.32 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.595 -170.184 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -80.42 8.48 7.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.698 -0.627 . . . . 0.0 110.288 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.98 12.39 11.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 172.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.508 -177.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.2 mmtt . . . . . 0 C--O 1.232 0.182 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.26 138.7 40.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.885 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.44 93.38 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.159 0.504 . . . . 0.0 111.65 -176.694 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.6 m -76.49 113.78 14.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.216 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.672 HD11 ' HB2' ' A' ' 98' ' ' PHE . 0.0 OUTLIER -113.22 125.62 54.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 177.491 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.927 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 12.4 ttm105 -78.48 98.35 6.03 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.023 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -105.33 155.32 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.256 -176.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.67 103.08 5.11 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.004 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -81.82 138.43 35.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.973 0.415 . . . . 0.0 110.991 -177.904 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.545 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.82 163.76 17.43 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.638 176.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.545 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 33.3 Cg_endo -62.43 -11.89 25.07 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.348 2.032 . . . . 0.0 112.062 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.41 -4.35 59.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.912 177.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.96 10.55 84.86 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.606 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.46 154.12 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.744 0.307 . . . . 0.0 110.473 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.36 102.07 14.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.093 179.001 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.478 HD11 ' HB2' ' A' ' 49' ' ' ALA . 0.8 OUTLIER -65.2 -42.78 93.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.143 0.497 . . . . 0.0 110.248 -179.6 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -128.31 144.26 51.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.2 tt -158.1 106.34 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.365 0.602 . . . . 0.0 109.408 177.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -135.15 123.63 15.82 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.032 -174.029 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.592 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 21.6 Cg_exo -65.64 120.7 7.93 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.974 2.449 . . . . 0.0 112.15 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -61.86 1.86 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -166.63 -176.71 37.95 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.029 177.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.5 -89.22 0.43 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 -178.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 64' ' ' PRO . 13.1 t70 -133.91 110.29 12.01 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 120.78 0.324 . . . . 0.0 110.518 176.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 63' ' ' ASP . 11.0 Cg_endo -55.99 -36.08 95.43 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 122.717 2.278 . . . . 0.0 112.787 -177.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.84 -53.09 12.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.307 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.915 0.388 . . . . 0.0 110.9 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.592 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 8.5 m -64.74 -42.59 95.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.606 -178.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -68.82 -33.59 74.09 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.933 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.54 69.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 178.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.07 71.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 15.2 mt -61.16 -37.06 81.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.788 0.327 . . . . 0.0 111.14 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.27 -40.93 77.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.873 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.13 74.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.035 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.56 -26.91 68.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.383 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -78.05 -22.74 48.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mt -99.39 -11.4 21.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.501 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.11 125.69 27.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.278 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.91 99.14 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.812 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -112.89 124.72 31.11 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.616 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.7 168.41 19.5 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.55 2.167 . . . . 0.0 112.651 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 1.5 ttmt -66.92 127.73 93.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.494 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 7.0 Cg_endo -50.86 110.84 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.31 2.673 . . . . 0.0 112.577 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.74 -27.86 12.16 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.62 2.214 . . . . 0.0 111.457 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.5 ' HB2' HG23 ' A' ' 87' ' ' VAL . 0.6 OUTLIER -107.54 120.05 41.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.154 177.865 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -60.99 -32.07 71.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.12 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.68 78.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.92 0.391 . . . . 0.0 110.913 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.562 HG22 ' HA ' ' A' ' 16' ' ' ILE . 91.0 t -66.6 -44.62 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -62.41 -43.38 98.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.969 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.831 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 3.3 mm-40 -58.05 -32.52 68.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.31 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.23 -58.2 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.452 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -65.43 -18.94 65.71 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.831 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.73 -13.81 61.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.816 0.341 . . . . 0.0 110.918 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -153.08 46.78 0.69 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 110.695 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.82 101.3 11.7 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.812 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.927 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.6 Cg_exo -72.45 131.75 18.03 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.848 2.365 . . . . 0.0 111.53 -178.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.66 146.03 25.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.251 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -97.07 96.71 8.66 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.967 175.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.672 ' HB2' HD11 ' A' ' 44' ' ' LEU . 48.9 t80 -73.16 108.86 6.29 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.419 -173.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.69 135.73 25.43 Favored Pre-proline 0 C--N 1.315 -0.902 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--N 1.346 0.409 0 C-N-CA 123.913 3.075 . . . . 0.0 113.388 -175.693 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.412 HG23 ' CE2' ' A' ' 91' ' ' PHE . 3.2 mt . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -63.36 -37.89 89.04 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -175.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -33.84 76.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.028 0.442 . . . . 0.0 110.413 178.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -73.67 -48.7 30.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.697 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.81 -34.19 77.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.993 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.14 -35.95 91.19 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.191 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -65.85 -42.56 90.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.845 0.355 . . . . 0.0 110.994 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.551 HD12 ' HA ' ' A' ' 20' ' ' ALA . 44.8 mt -57.93 -44.29 86.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.37 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.2 mttp -55.16 -44.27 75.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.541 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.55 -36.67 44.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.975 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.17 -38.31 79.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.677 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 23' ' ' ILE . 6.3 mt -65.43 -38.32 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.985 -178.003 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -19.28 62.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.415 177.095 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -68.99 -23.64 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.149 0.5 . . . . 0.0 110.04 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 14.6 mmmt -96.18 -48.38 5.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.572 174.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.852 176.357 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.521 HG23 ' HG2' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -121.99 145.33 48.23 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.8 106.49 4.26 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.693 -177.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.605 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 20.0 m -78.94 113.33 16.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.661 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -108.63 114.25 27.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.196 -176.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.872 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 21.8 ttm180 -79.42 89.07 5.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.7 pt -95.28 111.88 26.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.569 -172.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -93.94 99.44 11.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.37 177.191 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.712 ' HG ' HD23 ' A' ' 54' ' ' LEU . 4.9 mt -85.33 139.51 31.52 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.126 0.489 . . . . 0.0 111.379 -175.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.446 ' HB2' ' CD2' ' A' ' 55' ' ' LEU . . . -96.0 158.8 33.55 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.279 177.574 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.7 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 32.4 Cg_exo -56.0 -24.09 46.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.966 2.444 . . . . 0.0 112.564 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.434 ' HB2' ' HG2' ' A' ' 53' ' ' MET . 1.4 m-20 -75.19 -9.08 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.127 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 44.75 6.48 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.774 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.434 ' HG2' ' HB2' ' A' ' 51' ' ' ASP . 1.4 ptt? -150.81 142.46 23.63 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.712 HD23 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -88.54 101.58 14.08 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.352 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.446 ' CD2' ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -71.87 -37.22 70.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.1 t70 -123.73 100.13 6.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -111.57 106.18 20.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -113.94 119.96 39.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.611 -170.347 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.684 ' HG3' HD21 ' A' ' 71' ' ' LEU . 2.7 Cg_exo -71.51 110.9 2.98 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.694 2.263 . . . . 0.0 111.176 175.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.419 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 45.7 mt-10 -73.8 -49.21 26.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.209 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 173.22 172.9 39.17 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.472 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.8 -90.66 0.24 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -143.45 112.34 5.5 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.32 -35.01 95.44 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.953 2.435 . . . . 0.0 112.275 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.81 83.38 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.283 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.0 tp -88.05 -40.4 13.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.626 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.599 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.6 m -60.64 -55.07 37.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.298 -175.441 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HA ' HD12 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -61.99 -29.72 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.681 0.277 . . . . 0.0 111.455 -176.51 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.95 -44.06 27.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.928 0.394 . . . . 0.0 110.851 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.99 -28.97 69.94 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.464 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.684 HD21 ' HG3' ' A' ' 59' ' ' PRO . 91.2 mt -54.58 -44.84 73.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.652 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.6 -41.19 32.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.4 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -57.68 -50.05 74.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.99 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.19 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.85 0.357 . . . . 0.0 111.49 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.641 ' HG2' HD12 ' A' ' 54' ' ' LEU . 2.8 mtmt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 179.13 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.417 ' HB3' ' HE2' ' A' ' 30' ' ' LYS . 4.7 mp -94.6 -19.76 20.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.878 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.44 158.4 26.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.673 -175.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.03 73.84 5.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.685 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.433 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.9 mm -76.3 120.07 80.04 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.712 178.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 33.7 Cg_exo -63.58 171.56 6.74 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.594 2.196 . . . . 0.0 112.339 -177.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.445 ' HG3' ' HD2' ' A' ' 82' ' ' PRO . 1.1 tppt? -90.98 135.01 29.14 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 175.162 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.445 ' HD2' ' HG3' ' A' ' 81' ' ' LYS . 78.4 Cg_exo -44.16 111.57 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.396 2.731 . . . . 0.0 112.785 -178.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -62.99 -66.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.721 2.28 . . . . 0.0 112.25 -176.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.33 -179.37 3.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.778 0.323 . . . . 0.0 110.637 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -16.49 61.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.073 -177.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.31 -57.8 9.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.467 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.7 t -60.51 -37.57 75.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.63 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.7 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 29.3 t80 -54.0 -52.83 59.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.636 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.531 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 44.6 mm-40 -77.89 -40.81 38.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 111.534 -177.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.68 -52.56 22.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.981 -173.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.525 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 2.2 m-85 -72.69 -5.21 36.03 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -176.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 7.4 mtmt -65.92 -21.34 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 171.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.87 55.37 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.709 179.116 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.525 ' HB3' ' HA ' ' A' ' 91' ' ' PHE . . . -123.26 93.53 47.89 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -178.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.872 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.4 Cg_exo -73.73 140.08 28.78 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 123.013 2.475 . . . . 0.0 111.941 -178.185 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.35 135.08 55.14 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.57 -177.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.605 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 25.5 t0 -84.09 103.32 13.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 175.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.61 108.62 3.92 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.082 -175.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.521 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -119.9 116.82 32.69 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.536 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 C--N 1.35 0.612 0 C-N-CA 124.103 3.202 . . . . 0.0 113.356 -177.33 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 120.899 0.38 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -35.36 78.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.973 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -66.47 -48.36 70.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.73 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.45 80.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.298 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.19 -35.56 77.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.765 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.79 -37.12 88.28 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.571 177.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.06 -37.15 86.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.889 0.376 . . . . 0.0 110.632 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 36.1 mt -73.29 -40.07 56.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.409 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.72 -38.0 71.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.433 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.54 -42.81 28.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.867 0.365 . . . . 0.0 110.704 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.61 -47.31 86.07 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.406 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.446 HG23 ' HB1' ' A' ' 73' ' ' ALA . 4.6 mt -64.39 -39.33 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.311 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -21.18 64.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.459 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.44 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 4.3 m -96.53 17.81 15.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.117 0.484 . . . . 0.0 110.691 177.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 29' ' ' SER . 10.1 mmtt -150.81 32.14 0.62 Allowed 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.4 p90 . . . . . 0 N--CA 1.436 -1.158 0 CA-C-N 113.487 -1.688 . . . . 0.0 113.013 -167.827 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.723 ' HB2' HD23 ' A' ' 66' ' ' LEU . 23.2 mttm . . . . . 0 N--CA 1.452 -0.364 0 CA-C-O 120.733 0.301 . . . . 0.0 110.38 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.17 149.09 39.27 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.42 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 33.4 t -152.37 116.6 4.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.041 0.448 . . . . 0.0 111.816 -178.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.896 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.9 m -76.03 121.43 22.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.42 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.7 mt -105.61 129.48 53.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 0.0 110.252 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HB3' ' HD2' ' A' ' 58' ' ' LYS . 8.6 ttt-85 -86.86 93.3 9.26 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.82 113.68 34.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.304 -173.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -101.01 100.86 11.53 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 175.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 91' ' ' PHE . 35.2 mt -93.15 130.03 38.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.947 -175.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.742 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -76.39 138.72 67.57 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 172.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.65 -17.82 18.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.349 2.699 . . . . 0.0 113.342 -175.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -81.32 -0.41 40.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.328 . . . . 0.0 111.174 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.67 63.88 1.52 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.564 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.742 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 1.8 ptp -159.68 135.61 8.68 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.648 HD21 HD13 ' A' ' 79' ' ' ILE . 0.0 OUTLIER -91.26 87.82 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.155 0.503 . . . . 0.0 110.043 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.477 ' HG ' ' N ' ' A' ' 56' ' ' ASP . 0.4 OUTLIER -76.59 -29.43 56.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.378 -178.661 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.477 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 29.7 t70 -130.52 92.52 3.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.38 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 tt -124.36 106.71 17.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.609 ' HD2' ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -134.3 142.6 43.6 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.47 -173.14 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.483 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 8.9 Cg_exo -69.82 132.29 22.92 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.055 2.503 . . . . 0.0 111.504 177.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -98.98 -76.58 0.53 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.418 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -133.14 145.69 17.67 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.467 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 135.69 -154.26 21.71 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.187 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -88.53 120.46 70.32 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -56.01 -27.27 63.31 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.99 2.46 . . . . 0.0 112.859 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.29 -42.64 75.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.706 0.289 . . . . 0.0 110.43 176.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.723 HD23 ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.716 174.736 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.559 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 8.8 m -63.07 -56.23 18.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.506 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -38.11 84.91 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.602 -174.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.53 -41.8 92.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.216 177.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.82 -38.98 87.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.021 177.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 17.8 mt -57.1 -51.35 69.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.929 0.395 . . . . 0.0 110.859 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.44 -44.01 92.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.033 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.446 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.74 -40.42 95.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.443 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.93 -33.8 76.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.73 0.3 . . . . 0.0 111.293 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.42 -26.32 60.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.01 0.433 . . . . 0.0 110.635 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.453 HD13 ' HA ' ' A' ' 76' ' ' LEU . 1.3 mm? -88.01 -31.92 19.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.701 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.99 170.63 12.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.354 0.597 . . . . 0.0 111.821 -176.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -114.87 106.3 14.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.552 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.648 HD13 HD21 ' A' ' 54' ' ' LEU . 3.6 mp -103.77 110.4 63.86 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.9 Cg_exo -69.63 153.25 69.78 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.842 2.361 . . . . 0.0 112.558 -175.218 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -70.54 126.99 92.39 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.501 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.94 112.32 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.954 2.436 . . . . 0.0 113.218 -175.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -77.52 -21.34 11.6 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.62 2.213 . . . . 0.0 111.33 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -97.66 143.25 28.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.074 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.8 mm-40 -72.17 -27.62 62.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.758 0.313 . . . . 0.0 110.862 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.57 -52.03 65.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.284 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.417 ' O ' ' HB2' ' A' ' 91' ' ' PHE . 53.3 t -67.49 -37.15 78.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.627 177.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.472 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 4.8 t80 -53.72 -50.87 64.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.355 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.29 -27.12 47.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.093 -174.737 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.2 t -87.19 -43.01 15.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.896 -0.321 . . . . 0.0 111.507 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 48' ' ' LEU . 2.5 m-85 -77.8 -0.87 28.78 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -174.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 88' ' ' TYR . 8.5 mttt -57.29 -30.35 64.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.214 0.53 . . . . 0.0 110.478 176.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.528 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 62.7 t30 -158.3 76.08 0.75 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.465 172.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -107.68 95.35 14.06 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.342 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.528 ' HD3' ' O ' ' A' ' 93' ' ' ASN . 8.0 Cg_exo -73.6 104.5 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.651 2.234 . . . . 0.0 110.448 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.8 130.47 46.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.783 -173.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.896 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 32.9 t70 -75.13 102.1 4.81 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -70.38 116.98 11.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.37 0.605 . . . . 0.0 110.48 -175.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 4.7 tttt -131.62 128.05 21.67 Favored Pre-proline 0 C--N 1.312 -1.046 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.655 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 99' ' ' LYS . 3.2 Cg_exo . . . . . 0 C--N 1.349 0.6 0 C-N-CA 124.861 3.707 . . . . 0.0 111.837 177.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.476 HG12 HG23 ' A' ' 87' ' ' VAL . 52.8 mt . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.556 0.217 . . . . 0.0 111.45 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.69 -39.97 86.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.987 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -71.96 -41.47 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.037 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.9 -40.02 96.28 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.423 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -62.76 -37.33 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.783 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.24 -39.58 43.69 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.386 178.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -62.68 -26.46 68.67 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.285 0.234 . . . . 0.0 111.429 -178.291 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 20' ' ' ALA . 65.2 mt -62.91 -39.22 84.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.233 0.539 . . . . 0.0 110.03 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -74.07 -28.99 61.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.179 178.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -67.7 -39.33 84.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.725 0.298 . . . . 0.0 110.691 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.76 -31.78 68.67 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.476 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.618 HG23 ' HB3' ' A' ' 73' ' ' ALA . 43.2 mt -66.18 -31.65 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.665 -176.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.69 -33.1 68.53 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.108 -0.37 . . . . 0.0 111.108 179.495 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.24 4.8 1.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.761 178.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 1.6 mmmt -119.36 -0.54 10.92 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.478 ' CE2' ' HB1' ' A' ' 69' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.572 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.384 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.434 ' HB2' HD22 ' A' ' 66' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.301 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.1 m -118.13 121.2 39.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.911 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.452 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 6.0 t -115.91 151.09 36.0 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -137.56 102.2 4.7 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 0.0 110.387 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.14 136.12 41.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.409 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.794 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 ptm180 -85.21 124.91 32.4 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.06 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -127.7 111.09 23.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 121.167 0.508 . . . . 0.0 111.168 -173.108 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 92' ' ' LYS . 29.1 ttmt -108.0 104.22 13.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.373 -0.83 . . . . 0.0 108.891 176.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 tp -96.37 142.55 28.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.145 0.498 . . . . 0.0 111.898 -173.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.617 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.19 166.13 13.24 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.824 176.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.617 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 25.8 Cg_endo -61.81 -10.15 16.28 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.756 2.304 . . . . 0.0 112.703 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.35 -6.61 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.477 177.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 81' ' ' LYS . . . 78.36 16.92 78.8 Favored Glycine 0 CA--C 1.51 -0.25 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.89 -177.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -104.84 146.25 29.26 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -90.12 101.74 14.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -28.06 60.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.094 0.473 . . . . 0.0 110.07 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.593 ' HB3' ' HB3' ' A' ' 47' ' ' LYS . 28.7 t70 -128.93 104.15 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.538 175.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -133.76 111.74 15.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.34 148.09 15.19 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.408 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.617 ' HD3' HD11 ' A' ' 71' ' ' LEU . 39.3 Cg_endo -70.34 112.91 3.3 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 121.964 1.776 . . . . 0.0 111.656 177.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -73.45 -34.85 65.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.411 0.624 . . . . 0.0 109.589 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 176.88 -177.23 48.2 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.401 177.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.25 -150.84 17.43 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.013 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.3 112.55 42.3 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.784 0.326 . . . . 0.0 110.303 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.46 -40.26 82.54 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.339 2.693 . . . . 0.0 113.399 -174.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.0 -46.71 86.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.951 0.405 . . . . 0.0 111.188 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.434 HD22 ' HB2' ' A' ' 40' ' ' LYS . 16.3 tp -65.61 -38.9 90.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.553 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.551 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 24.9 m -67.93 -44.72 76.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.265 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.718 ' HA ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -62.17 -38.77 90.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.702 0.286 . . . . 0.0 110.822 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.478 ' HB1' ' CE2' ' A' ' 31' ' ' PHE . . . -60.73 -44.76 96.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.642 178.162 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.3 82.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.075 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 68' ' ' GLN . 51.7 mt -53.52 -46.64 70.18 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.708 -177.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.13 -37.24 46.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.618 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -75.64 -39.6 57.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.112 -175.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -32.01 73.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -176.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -67.91 -30.56 69.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.0 110.966 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 57.3 mt -98.23 -2.59 39.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.541 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -78.02 149.07 34.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.442 -179.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.95 66.45 6.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -178.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 53.4 mt -78.51 116.71 61.53 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.878 176.054 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 23.4 Cg_exo -67.29 151.53 80.66 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 123.011 2.474 . . . . 0.0 112.761 -175.537 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.508 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -73.86 138.62 76.52 Favored Pre-proline 0 N--CA 1.443 -0.821 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.453 175.364 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.04 106.92 0.22 Allowed 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.114 2.543 . . . . 0.0 112.835 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -77.16 -25.1 8.96 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.601 2.201 . . . . 0.0 111.832 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.42 135.26 54.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.695 177.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -66.51 -27.83 68.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.956 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.4 -37.26 86.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.141 0.496 . . . . 0.0 110.75 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.476 HG23 HG12 ' A' ' 16' ' ' ILE . 0.8 OUTLIER -71.99 -33.92 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.292 177.57 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -69.66 -31.63 69.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.514 176.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.898 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -65.9 -35.38 80.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.396 179.295 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t -79.69 -45.89 22.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.566 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.29 5.32 8.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.178 -176.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.898 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 6.1 ttmt -63.7 -23.69 67.47 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.229 0.538 . . . . 0.0 110.117 176.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -170.07 75.15 0.08 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.292 175.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.453 ' HB2' ' O ' ' A' ' 90' ' ' VAL . . . -122.09 85.2 46.02 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.452 -173.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.794 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 12.6 Cg_exo -73.05 104.51 1.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.747 2.298 . . . . 0.0 110.725 178.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 41.6 mt -95.24 158.84 15.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.823 -172.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -80.07 146.67 31.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.258 177.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.452 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 64.7 t80 -129.55 130.84 46.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.029 0.443 . . . . 0.0 110.507 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 165.6 34.23 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo . . . . . 0 C--N 1.344 0.333 0 C-N-CA 122.406 2.07 . . . . 0.0 113.202 -178.013 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -99.43 -8.77 24.27 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.641 -172.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.618 ' HD2' HG23 ' A' ' 6' ' ' THR . 32.1 m-85 67.81 174.78 0.27 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.9 176.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.49 -15.39 53.28 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -159.27 94.53 1.19 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.074 0.464 . . . . 0.0 109.779 178.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.618 HG23 ' HD2' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -84.26 -30.68 25.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.01 -176.63 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.23 -68.58 0.32 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.235 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -153.42 65.78 0.76 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.341 0.591 . . . . 0.0 109.658 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -131.45 -178.41 4.84 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.031 -178.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 113.81 2.62 23.84 Favored Glycine 0 N--CA 1.445 -0.748 0 C-N-CA 120.583 -0.817 . . . . 0.0 111.397 -176.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -165.67 23.25 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.878 0.371 . . . . 0.0 110.638 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.42 -22.94 21.19 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.995 0.426 . . . . 0.0 110.854 -178.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.567 ' HA2' HD12 ' A' ' 16' ' ' ILE . . . 116.29 -48.78 0.91 Allowed Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.666 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.08 -18.57 65.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.751 0.31 . . . . 0.0 111.174 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -47.33 62.06 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.813 175.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.567 HD12 ' HA2' ' A' ' 13' ' ' GLY . 2.5 mt -68.77 -39.49 80.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.225 176.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -62.91 -26.88 69.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.91 178.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.256 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.07 -31.11 69.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.469 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.31 64.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.288 0.566 . . . . 0.0 109.879 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.21 -32.28 72.39 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.833 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.449 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -60.06 -30.16 69.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.98 0.39 . . . . 0.0 110.894 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.552 ' O ' HG13 ' A' ' 27' ' ' ILE . 2.6 mt -76.36 -35.12 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.024 0.44 . . . . 0.0 109.954 176.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -62.28 -46.53 88.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.002 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.0 -34.46 75.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.232 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.39 -32.45 72.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.391 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 23' ' ' ILE . 8.5 mt -67.97 -32.81 57.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.707 -176.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.489 ' OE1' ' HB2' ' A' ' 101' ' ' HIS . 0.1 OUTLIER -65.15 -40.08 93.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.639 0.257 . . . . 0.0 111.208 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.41 14.13 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -119.26 -8.55 10.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 176.978 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -122.71 -64.73 1.16 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.723 176.076 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.549 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 0.2 OUTLIER 161.44 -154.87 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 -177.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -86.62 23.59 1.63 Allowed 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 160.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.533 ' H ' ' HB3' ' A' ' 32' ' ' TYR . . . -78.03 -35.44 49.77 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 112.925 -1.943 . . . . 0.0 109.942 176.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.9 -17.48 64.92 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.497 176.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.6 m -81.72 65.77 6.99 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.034 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.41 -142.63 0.1 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.462 175.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.659 ' HA ' ' HG2' ' A' ' 100' ' ' PRO . . . -176.13 157.28 1.8 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.853 0.359 . . . . 0.0 111.049 172.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.15 30.52 69.62 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.876 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.467 ' HB2' HD22 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -135.06 162.78 31.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.895 0.379 . . . . 0.0 110.876 -179.617 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -141.14 139.66 33.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.785 176.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.623 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 52.8 t -138.05 79.6 1.75 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.47 0.652 . . . . 0.0 110.823 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -70.14 120.99 16.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.012 176.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.585 HD23 ' HA ' ' A' ' 59' ' ' PRO . 67.0 mt -113.64 124.56 52.62 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.91 0.386 . . . . 0.0 110.666 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -81.02 88.17 5.96 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.3 pt -113.89 152.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.447 -174.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 56' ' ' ASP . 5.0 mtmt -140.33 112.62 7.81 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.375 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 2.3 tp -95.55 118.65 32.65 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 120.915 0.388 . . . . 0.0 110.952 -177.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.621 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -67.57 159.05 80.47 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.979 176.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.471 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 37.4 Cg_exo -57.04 -15.91 19.15 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.864 2.376 . . . . 0.0 112.777 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.83 -0.93 57.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.327 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.52 52.94 4.89 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.52 -0.848 . . . . 0.0 112.426 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.71 140.61 23.78 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.16 107.54 17.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.006 0.431 . . . . 0.0 110.657 -178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.621 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -76.6 -37.37 56.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.902 177.54 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.616 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -112.7 140.15 47.72 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.885 178.723 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -158.82 106.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.364 0.602 . . . . 0.0 110.128 177.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.402 ' HG3' ' HD2' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -140.43 127.05 12.02 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.191 -175.463 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.585 ' HA ' HD23 ' A' ' 44' ' ' LEU . 64.1 Cg_endo -76.62 111.08 3.18 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.701 2.267 . . . . 0.0 112.422 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -124.17 21.46 8.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.736 0.779 . . . . 0.0 109.957 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.45 ' HA2' ' HB ' ' A' ' 43' ' ' THR . . . -79.81 -151.84 7.04 Favored Glycine 0 C--N 1.32 -0.345 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.368 -177.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -115.85 -13.02 8.87 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.822 -0.704 . . . . 0.0 113.2 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -117.63 112.46 38.93 Favored Pre-proline 0 C--N 1.327 -0.403 0 O-C-N 122.551 -0.381 . . . . 0.0 110.466 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.445 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 36.7 Cg_endo -68.96 -27.38 30.43 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.691 2.261 . . . . 0.0 112.886 -176.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -77.71 -51.74 10.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.735 0.302 . . . . 0.0 110.85 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.467 HD22 ' HB2' ' A' ' 40' ' ' LYS . 12.8 tp -56.87 -44.05 81.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.387 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.2 m -69.76 -38.89 76.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.914 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.445 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 1.3 mp0 -62.18 -40.83 97.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.011 0.434 . . . . 0.0 110.888 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.72 55.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.032 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.62 -37.94 76.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.812 -178.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 22.0 mt -55.3 -44.03 75.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.771 0.32 . . . . 0.0 111.198 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.41 46.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.267 -178.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.83 91.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.554 -177.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.33 79.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 111.196 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.007 0.432 . . . . 0.0 110.967 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 mt -92.27 -3.6 55.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.694 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -80.08 168.3 19.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -100.56 106.63 18.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 110.906 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mp -119.35 116.89 33.44 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.104 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -78.96 172.44 14.95 Favored 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 122.733 2.289 . . . . 0.0 113.066 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 124.33 89.78 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.195 178.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.488 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 68.7 Cg_exo -53.61 114.99 2.02 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.236 2.624 . . . . 0.0 112.646 -178.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 7.2 Cg_endo -92.14 -75.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.351 2.701 . . . . 0.0 112.903 -174.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.35 134.63 56.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.804 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.77 -36.48 74.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.49 -176.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.01 -47.36 83.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.829 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 83.7 t -66.72 -43.62 89.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.441 178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.471 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 6.1 t80 -60.87 -41.58 96.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.116 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.452 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 16.4 mm-40 -62.92 -24.77 68.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 0.0 111.234 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.406 HG12 ' HB2' ' A' ' 94' ' ' ALA . 93.3 t -92.43 -45.01 14.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.624 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.406 ' HD1' ' HA ' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -59.95 -30.47 69.1 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -175.228 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 48' ' ' LEU . 3.1 ptpt -66.27 -8.22 23.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.731 0.3 . . . . 0.0 111.602 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -164.38 59.94 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.914 0.387 . . . . 0.0 110.114 176.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.406 ' HB2' HG12 ' A' ' 90' ' ' VAL . . . -115.75 89.2 22.72 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.171 -178.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.546 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 2.3 Cg_endo -76.1 103.14 1.69 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.07 1.847 . . . . 0.0 110.399 175.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.0 mt -102.75 153.24 20.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.973 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.573 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -94.38 132.35 39.1 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.023 175.121 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.623 ' O ' ' HB3' ' A' ' 42' ' ' CYS . 82.4 m-85 -113.98 98.92 7.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.473 0.654 . . . . 0.0 110.075 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.681 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -112.23 173.99 2.57 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.608 177.822 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.681 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 35.5 Cg_exo -37.27 119.94 0.29 Allowed 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 123.092 2.528 . . . . 0.0 112.855 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.489 ' HB2' ' OE1' ' A' ' 28' ' ' GLU . 2.5 m80 -91.45 157.28 17.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.736 -172.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.7 p80 . . . . . 0 C--O 1.242 0.681 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.568 -177.258 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 121.408 0.623 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.588 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 0.5 OUTLIER -77.9 140.87 39.32 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.524 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -106.83 49.04 0.81 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.029 0.442 . . . . 0.0 110.236 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.19 -136.26 32.36 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 -175.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -144.45 124.72 13.77 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.67 0.271 . . . . 0.0 110.52 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.9 m 65.93 77.66 0.29 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.677 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -90.78 36.67 0.9 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.408 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -125.38 154.27 42.14 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.18 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.7 t-20 -163.75 95.2 0.79 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.974 0.416 . . . . 0.0 110.115 178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.15 -165.55 11.94 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.978 -177.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -162.56 178.43 8.57 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.07 125.89 28.09 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.306 178.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 99.33 40.73 3.16 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -173.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 18' ' ' ASN . . . -60.86 -27.54 68.19 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 122.421 0.288 . . . . 0.0 111.526 -178.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -59.69 -55.64 31.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.193 0.521 . . . . 0.0 110.567 178.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -70.16 -42.74 79.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.121 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.32 -29.84 71.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.623 -177.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 21.8 t-20 -62.37 -46.22 89.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.875 0.369 . . . . 0.0 110.741 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.68 -28.91 51.2 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.831 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.63 -35.99 82.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 110.33 175.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.1 -33.88 84.71 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.796 177.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -45.72 92.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.2 mt -64.82 -45.68 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.798 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -60.33 -35.92 76.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.016 0.436 . . . . 0.0 110.948 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -72.81 -40.55 65.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.501 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.5 -38.48 77.74 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.739 0.78 . . . . 0.0 110.631 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.544 HG23 ' HB3' ' A' ' 73' ' ' ALA . 8.5 mt -66.04 -43.44 92.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.262 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.525 ' CG ' ' HB2' ' A' ' 35' ' ' SER . 0.8 OUTLIER -76.12 -22.12 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -178.082 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -26.21 60.78 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.839 177.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.446 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.32 -51.9 7.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.891 174.757 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.825 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 4.1 m-85 -97.9 75.61 2.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.057 0.456 . . . . 0.0 110.006 177.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.24 -51.6 63.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.451 -1.249 . . . . 0.0 113.62 -170.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -102.93 -9.77 19.57 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 122.587 1.184 . . . . 0.0 110.968 -173.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.825 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -79.32 -56.55 4.26 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 113.445 -1.707 . . . . 0.0 111.824 177.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.525 ' HB2' ' CG ' ' A' ' 28' ' ' GLU . 46.4 m -73.41 -15.48 61.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.518 -173.152 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 p -87.97 49.12 1.74 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.135 0.493 . . . . 0.0 110.732 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -86.94 -65.86 0.97 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.661 -175.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.778 ' H ' ' HB2' ' A' ' 100' ' ' PRO . . . 72.26 173.56 0.3 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.807 -173.038 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.64 -50.78 4.47 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.9 -177.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.426 ' HB2' HD22 ' A' ' 66' ' ' LEU . 8.9 mmtp -97.49 165.79 11.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.827 0.346 . . . . 0.0 111.234 -177.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.18 156.78 44.73 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.287 176.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.71 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 8.2 t -142.52 151.39 41.58 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.0 m -125.16 103.23 7.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.218 0.532 . . . . 0.0 110.907 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.8 mt -92.59 113.18 25.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.009 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.725 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.3 mmt-85 -81.73 88.17 6.29 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.2 pt -101.04 151.74 5.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.074 -174.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HB3' ' HE2' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -134.7 89.17 2.51 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.92 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.6 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 1.6 tp -80.74 123.2 28.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.393 -172.565 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.434 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -74.31 152.29 87.95 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 173.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -57.37 -16.4 22.76 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.053 2.502 . . . . 0.0 112.58 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.88 -14.34 62.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.723 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.05 59.94 2.23 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.807 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.97 146.11 20.21 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.36 82.1 2.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.321 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.477 ' H ' ' HG ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -73.9 -19.57 60.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 177.801 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.482 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -125.05 117.26 23.57 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.488 177.391 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.5 tt -159.46 111.03 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.499 . . . . 0.0 110.531 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.5 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -137.74 135.05 18.58 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.183 -177.238 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.747 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 2.0 Cg_endo -80.64 74.36 5.58 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.414 2.743 . . . . 0.0 111.308 177.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.611 ' HB2' ' HG3' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -65.37 -34.15 77.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.081 -175.503 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -144.16 163.38 27.77 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.099 177.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.708 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 109.84 179.77 20.83 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.181 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.11 123.41 87.22 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-O 120.352 0.12 . . . . 0.0 110.797 -179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -53.41 -46.05 36.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.327 2.685 . . . . 0.0 113.234 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.1 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.822 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 100' ' ' PRO . 14.0 tp -59.82 -43.9 94.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.845 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.747 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 92.7 m -64.62 -37.74 88.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.828 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 71' ' ' LEU . 2.4 tt0 -63.07 -40.77 98.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.868 0.366 . . . . 0.0 110.896 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.31 -45.61 92.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.429 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.46 -31.27 70.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.424 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 23.1 mt -55.7 -52.26 64.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.124 0.488 . . . . 0.0 111.328 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -76.86 -36.69 56.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.986 -177.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.544 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -64.05 -46.65 83.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.734 -178.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.33 90.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.708 0.29 . . . . 0.0 111.58 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -71.31 -26.95 63.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.446 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.6 OUTLIER -92.95 -2.42 55.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.739 178.401 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.501 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -90.9 156.99 17.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.282 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -97.5 101.2 12.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.071 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -88.54 115.59 63.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.795 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.31 130.76 35.36 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.537 2.158 . . . . 0.0 112.024 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.427 ' HG2' ' H ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -59.92 121.16 56.34 Favored Pre-proline 0 N--CA 1.445 -0.713 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.891 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.429 ' CB ' ' HB2' ' A' ' 88' ' ' TYR . 47.0 Cg_exo -39.17 104.62 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 124.307 3.338 . . . . 0.0 114.492 -173.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -83.58 -52.2 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.895 2.397 . . . . 0.0 111.843 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.66 126.46 31.04 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -66.47 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.167 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.34 -43.22 86.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 174.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.618 HG13 ' HD2' ' A' ' 91' ' ' PHE . 1.8 t -62.48 -42.54 96.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.606 175.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.429 ' HB2' ' CB ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -60.87 -44.51 96.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.001 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.869 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -70.78 -21.24 62.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -175.797 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.4 t -92.53 -55.0 6.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.699 0.285 . . . . 0.0 111.245 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.618 ' HD2' HG13 ' A' ' 87' ' ' VAL . 12.9 m-85 -67.48 -14.95 63.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -173.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.869 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 3.4 pttp -70.31 -6.01 32.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.018 0.437 . . . . 0.0 110.679 177.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -164.93 67.69 0.14 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.103 173.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -136.24 97.85 11.76 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.866 -176.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.725 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 13.2 Cg_exo -72.02 112.6 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.466 2.111 . . . . 0.0 110.262 178.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.455 HD11 ' HE1' ' A' ' 91' ' ' PHE . 11.8 mt -88.54 149.15 23.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.993 -168.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.61 126.51 34.55 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.585 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.71 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 19.4 t80 -98.54 102.8 14.65 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.1 0.476 . . . . 0.0 109.824 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -109.86 100.09 41.45 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 174.861 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.778 ' HB2' ' H ' ' A' ' 38' ' ' ALA . 2.6 Cg_endo -53.76 139.23 68.43 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 123.334 2.689 . . . . 0.0 113.191 -170.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -59.22 160.73 6.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.993 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.1 p80 . . . . . 0 C--O 1.246 0.914 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.423 174.45 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -103.34 135.7 44.48 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 178.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -105.68 94.3 5.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.868 0.366 . . . . 0.0 110.066 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.418 ' O ' ' HB3' ' A' ' 5' ' ' ASN . . . -79.38 62.7 4.04 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.828 -177.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.418 ' HB3' ' O ' ' A' ' 4' ' ' GLY . 4.0 t30 70.29 -60.65 0.48 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.433 0.693 . . . . 0.0 111.945 178.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -15.48 31.61 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 122.352 -0.218 . . . . 0.0 111.441 -176.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 8' ' ' ASN . 0.4 OUTLIER 62.98 80.36 0.23 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.245 -177.918 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 21.0 t-20 72.63 -70.62 0.16 Allowed 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.272 -177.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -155.35 150.21 26.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.844 0.354 . . . . 0.0 110.583 177.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.56 100.26 0.22 Allowed Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.944 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.39 113.72 3.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.967 0.413 . . . . 0.0 111.006 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.49 -176.6 3.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.832 -178.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 98.9 169.93 31.07 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.492 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -105.95 -67.5 0.92 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.609 0.242 . . . . 0.0 110.55 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -57.42 11.79 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.578 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 95.8 mt -56.87 -44.61 82.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.416 -178.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -65.8 -41.73 91.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.167 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -62.5 -46.06 90.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.467 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.432 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -62.06 -48.11 81.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.772 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -63.66 -29.94 71.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.105 0.478 . . . . 0.0 110.862 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.35 -51.84 20.03 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.524 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 3.6 pt20 -66.12 -26.59 67.52 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.719 HG12 HD12 ' A' ' 79' ' ' ILE . 52.5 mt -64.08 -40.54 89.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 20' ' ' ALA . 3.6 mttp -63.93 -42.07 97.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.298 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 m -62.95 -47.18 84.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.942 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.78 -44.59 77.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.282 0.563 . . . . 0.0 110.545 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.2 mt -61.88 -42.0 92.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.378 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.494 ' C ' ' H ' ' A' ' 30' ' ' LYS . 4.0 tm-20 -76.39 -27.7 56.46 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.254 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.3 m -76.9 24.48 0.16 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.561 0.696 . . . . 0.0 110.72 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -133.34 -33.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.739 177.725 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.778 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 1.0 OUTLIER -113.85 -25.98 8.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.59 -176.461 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 62.02 -121.13 0.71 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.509 0.723 . . . . 0.0 111.901 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -71.56 4.59 2.96 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.665 0.745 . . . . 0.0 112.062 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.778 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -79.02 -46.07 18.91 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 113.84 -1.527 . . . . 0.0 109.805 169.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -21.75 60.31 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.984 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.5 m -81.38 72.19 8.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.569 -0.742 . . . . 0.0 109.812 175.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.769 ' H ' ' HB3' ' A' ' 100' ' ' PRO . 0.4 OUTLIER -92.56 -93.84 0.15 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.041 -171.862 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.476 ' H ' ' HG2' ' A' ' 100' ' ' PRO . . . -156.5 -167.49 2.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.054 -175.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -80.49 61.97 4.38 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.132 -0.556 . . . . 0.0 112.615 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.05 172.59 7.07 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.37 134.73 31.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.14 92.32 3.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.099 0.476 . . . . 0.0 110.684 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.487 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -67.04 118.23 10.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.0 mt -108.42 118.46 36.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.755 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.3 mtt180 -82.26 89.57 6.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.784 177.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.31 148.13 6.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.795 -173.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.562 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 11.1 mttt -130.18 103.71 6.89 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.988 176.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.24 145.84 25.14 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.086 0.47 . . . . 0.0 111.701 -174.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -96.54 160.9 28.46 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.864 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 27.4 Cg_endo -63.88 0.81 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.035 2.49 . . . . 0.0 113.319 -178.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -104.12 -2.39 25.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.014 0.435 . . . . 0.0 110.555 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.491 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 97.31 -23.66 34.83 Favored Glycine 0 C--O 1.226 -0.354 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.585 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.9 ptm -73.31 148.98 43.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.746 0.308 . . . . 0.0 110.446 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -85.8 124.79 32.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.808 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.88 -14.7 33.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.167 0.508 . . . . 0.0 109.947 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.562 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 42.4 t0 -160.44 140.08 11.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.919 178.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 5.7 tt -159.25 113.32 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 120.971 0.415 . . . . 0.0 110.321 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HB3' ' HE3' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -141.46 142.08 25.18 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.725 -178.488 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.531 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 14.7 Cg_exo -69.72 128.98 16.84 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.477 ' HB3' ' HB ' ' A' ' 43' ' ' THR . 22.8 tt0 -83.19 -57.91 3.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.575 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -156.07 144.46 10.9 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.58 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 158.53 -133.42 3.43 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.384 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -113.52 125.32 29.76 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.84 -43.88 52.74 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.98 2.454 . . . . 0.0 112.82 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.81 -52.01 42.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.126 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD21 ' HD3' ' A' ' 100' ' ' PRO . 23.1 tp -57.43 -47.3 82.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.968 0.413 . . . . 0.0 110.97 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.2 m -63.61 -42.71 98.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.06 -178.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -63.15 -41.01 99.19 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.814 0.34 . . . . 0.0 110.819 179.033 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.452 ' HB1' ' HE2' ' A' ' 31' ' ' PHE . . . -65.7 -42.33 91.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.564 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.53 -37.6 81.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.113 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.759 HD12 ' HA ' ' A' ' 68' ' ' GLN . 24.9 mt -59.82 -50.14 74.96 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.587 178.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.13 97.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.168 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.38 81.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.212 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.75 -27.78 69.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.292 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt -69.32 -34.6 74.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.626 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.492 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -85.95 -28.49 24.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -178.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 126.94 31.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.1 mtpt -94.85 107.27 19.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.876 -177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.719 HD12 HG12 ' A' ' 23' ' ' ILE . 6.9 mm -81.42 128.22 70.71 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.062 177.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 17.9 Cg_exo -64.93 132.35 31.98 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.747 2.298 . . . . 0.0 111.01 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.485 ' HB3' ' HE2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -53.11 128.04 47.54 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.011 -177.094 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 20.4 Cg_endo -64.49 121.32 8.87 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.782 2.321 . . . . 0.0 112.001 -176.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 6.6 Cg_endo -83.91 -69.06 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.926 2.417 . . . . 0.0 112.53 -176.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.22 134.07 55.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.233 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.41 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 2.1 mt-30 -55.12 -40.42 70.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.726 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.46 -50.97 71.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.951 0.405 . . . . 0.0 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.1 -42.02 95.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.973 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -65.26 -36.01 82.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.395 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 19.8 mm-40 -76.48 -40.29 50.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.0 110.549 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.2 t -64.33 -46.03 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.177 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -76.99 -6.19 51.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.667 -177.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 8.2 mttt -61.32 -23.72 65.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.023 0.44 . . . . 0.0 110.258 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.48 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 35.0 t30 -158.11 74.82 0.73 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.968 174.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -116.86 81.95 12.63 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.084 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.755 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.7 Cg_exo -73.41 104.83 1.87 Allowed 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.751 2.3 . . . . 0.0 111.192 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.6 146.34 23.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.204 -174.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.487 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -79.18 94.15 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.943 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.447 ' HZ ' HG22 ' A' ' 23' ' ' ILE . 1.1 m-85 -86.14 103.2 14.57 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.628 0.727 . . . . 0.0 110.894 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -109.92 158.21 35.6 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.46 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.769 ' HB3' ' H ' ' A' ' 37' ' ' TYR . 79.0 Cg_exo -53.5 97.66 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.685 2.257 . . . . 0.0 111.582 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -89.29 129.86 35.78 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.521 -170.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 8.7 p-80 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.07 -0.967 . . . . 0.0 109.539 175.378 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.113 0 CA-C-O 120.701 0.286 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -109.91 148.58 31.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.763 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.14 -103.36 0.38 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.101 0.477 . . . . 0.0 111.421 -178.111 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.16 94.53 1.08 Allowed Glycine 0 N--CA 1.444 -0.788 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -174.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -83.4 -52.91 6.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.743 0.306 . . . . 0.0 111.611 -171.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.84 91.68 5.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.65 -176.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.08 151.67 4.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.111 177.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -91.34 129.67 37.3 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 177.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.14 115.61 6.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.561 -177.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 146.49 121.83 1.36 Allowed Glycine 0 N--CA 1.443 -0.84 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.956 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.37 -29.68 62.79 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -109.34 174.88 5.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.505 172.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.92 90.61 0.98 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.639 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.3 -38.6 85.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.01 0.434 . . . . 0.0 109.976 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.6 -38.24 90.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.027 176.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.504 HD13 HG23 ' A' ' 87' ' ' VAL . 24.6 mm -61.02 -43.46 96.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.65 177.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -44.07 95.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.099 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.435 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 4.5 t-20 -68.45 -32.89 73.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.09 -48.19 45.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.739 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB2' ' HZ ' ' A' ' 91' ' ' PHE . . . -58.2 -49.05 78.41 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.162 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -61.7 -43.02 99.81 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.344 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -60.87 -32.52 71.95 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.655 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.419 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 52.6 mt -67.68 -42.41 86.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.852 0.358 . . . . 0.0 110.362 178.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.534 ' HB3' ' CE1' ' A' ' 101' ' ' HIS . 0.6 OUTLIER -64.81 -40.3 95.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.716 176.917 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.586 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 12.4 m -64.8 -41.98 95.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.97 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -56.37 -50.42 71.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.5 mt -63.46 -43.85 98.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.5 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.586 ' OE1' ' HA ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -65.61 -26.38 67.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.792 0.33 . . . . 0.0 111.069 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.3 m -76.44 -1.93 29.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.752 0.31 . . . . 0.0 111.093 177.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 6.2 mmtt -115.17 2.14 14.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 0.0 110.636 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.603 ' HB3' ' O ' ' A' ' 33' ' ' ASP . 0.0 OUTLIER -82.32 136.27 35.05 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.559 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -54.61 -60.16 3.73 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.244 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.643 ' HB3' ' HA ' ' A' ' 36' ' ' SER . 5.0 t70 -89.16 149.48 23.13 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 106.085 -1.821 . . . . 0.0 106.085 164.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -46.64 -52.77 12.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 118.241 0.473 . . . . 0.0 110.482 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.741 ' HB3' ' HB2' ' A' ' 102' ' ' HIS . 0.2 OUTLIER -83.18 -44.15 15.36 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.992 172.092 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.643 ' HA ' ' HB3' ' A' ' 33' ' ' ASP . 38.2 m 71.36 -46.27 0.64 Allowed 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.775 0.83 . . . . 0.0 111.67 -173.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -129.43 -176.81 4.01 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -174.41 155.59 2.34 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.579 0.549 . . . . 0.0 110.093 177.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.1 18.43 72.07 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.761 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.29 158.07 43.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.737 0.303 . . . . 0.0 110.439 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.81 HG23 ' HG3' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -122.66 162.14 22.5 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.208 177.633 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.677 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 43.2 t -146.79 142.01 27.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.548 -178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.98 104.27 7.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.517 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.42 125.48 51.03 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.913 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.967 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.4 OUTLIER -74.05 127.81 33.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 173.976 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.478 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.1 pt -129.26 142.3 44.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.073 0.464 . . . . 0.0 110.217 -178.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HB2' ' CB ' ' A' ' 56' ' ' ASP . 7.7 mtpt -133.02 115.29 14.98 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 48' ' ' LEU . 9.1 mt -79.9 130.2 35.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.129 0.49 . . . . 0.0 111.574 -173.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.34 158.61 43.25 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.9 176.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -59.75 -13.61 22.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.965 2.444 . . . . 0.0 113.361 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -98.79 -6.41 29.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.374 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.452 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 110.88 -19.8 25.08 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.29 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.36 158.66 27.39 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.921 0.36 . . . . 0.0 111.059 -178.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -88.98 106.94 18.75 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 175.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 pp -72.82 -31.88 65.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.304 -178.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.479 ' CB ' ' HB2' ' A' ' 47' ' ' LYS . 0.4 OUTLIER -118.74 124.8 48.17 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.718 176.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.505 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.1 tp -148.56 106.72 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.246 0.546 . . . . 0.0 109.648 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -147.86 128.45 6.89 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.96 -172.787 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.665 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 12.6 Cg_exo -70.26 92.7 0.56 Allowed 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.098 2.532 . . . . 0.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.33 -45.8 75.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.484 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -141.82 -179.12 18.61 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.504 -0.638 . . . . 0.0 111.504 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.677 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 102.32 -178.15 26.45 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.64 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.95 121.92 83.3 Favored Pre-proline 0 C--N 1.327 -0.399 0 C-N-CA 122.415 0.286 . . . . 0.0 110.49 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.82 -43.48 54.15 Favored 'Trans proline' 0 CA--C 1.528 0.216 0 C-N-CA 122.79 2.327 . . . . 0.0 112.74 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.19 -38.95 92.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.853 0.359 . . . . 0.0 111.17 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -71.49 -45.98 61.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.665 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 68.8 m -65.92 -38.99 90.15 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.703 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -64.55 -37.23 86.82 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.819 0.342 . . . . 0.0 110.455 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.07 -37.22 72.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.384 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.99 -27.91 69.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.004 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.5 mt -61.1 -45.31 95.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 110.365 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.25 86.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.621 178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.45 -44.14 92.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.341 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.99 70.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -74.83 -25.98 59.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.339 177.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.0 -13.43 50.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.316 0.579 . . . . 0.0 110.296 177.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -86.28 149.23 25.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.096 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -125.86 91.37 3.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.851 0.357 . . . . 0.0 110.075 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 52' ' ' GLY . 29.2 mm -66.24 127.84 93.49 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.656 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -67.48 153.64 76.0 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.57 2.18 . . . . 0.0 112.263 -175.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.23 122.14 73.7 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.925 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 50.3 Cg_exo -41.34 118.45 0.77 Allowed 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 123.835 3.023 . . . . 0.0 113.879 -174.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 3.1 Cg_endo -79.38 -75.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 123.109 2.539 . . . . 0.0 111.38 177.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.8 124.98 27.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.895 175.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -64.01 -26.97 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.58 0.229 . . . . 0.0 111.021 -177.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.02 -25.9 68.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.204 0.526 . . . . 0.0 110.969 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.504 HG23 HD13 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -77.65 -30.65 16.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.795 178.767 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -78.6 -38.0 41.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.271 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 25.7 pt-20 -67.76 -18.67 64.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.87 0.367 . . . . 0.0 110.877 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -92.07 -49.54 13.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.681 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.565 ' HZ ' ' HB2' ' A' ' 20' ' ' ALA . 22.4 m-85 -87.81 26.24 1.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.1 ttmt -73.08 -31.07 64.13 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.082 0.468 . . . . 0.0 110.27 177.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.447 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 12.5 p-10 -151.87 38.47 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.106 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -102.85 103.63 34.46 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.967 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.9 Cg_exo -72.25 155.11 56.53 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.886 2.391 . . . . 0.0 112.037 -174.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.471 HD22 ' HA ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -99.19 132.44 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.294 -172.665 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -92.19 120.07 32.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.98 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -117.02 142.49 46.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.382 0.611 . . . . 0.0 111.723 -172.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.81 ' HG3' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -145.18 143.56 20.79 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.532 174.226 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.55 107.38 0.2 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.665 2.243 . . . . 0.0 111.737 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.534 ' CE1' ' HB3' ' A' ' 24' ' ' LYS . 1.2 m170 -68.2 95.67 0.59 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.459 0.647 . . . . 0.0 111.748 -173.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.741 ' HB2' ' HB3' ' A' ' 35' ' ' SER . 16.0 t-80 . . . . . 0 C--O 1.251 1.169 0 CA-C-O 117.867 -1.063 . . . . 0.0 109.014 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.067 0 CA-C-O 120.733 0.301 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.792 ' HG2' ' H ' ' A' ' 4' ' ' GLY . 0.0 OUTLIER -92.16 -27.96 17.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.839 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 66.48 22.65 10.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.762 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.792 ' H ' ' HG2' ' A' ' 2' ' ' GLU . . . 43.99 -109.28 0.24 Allowed Glycine 0 C--N 1.337 0.63 0 O-C-N 123.882 0.739 . . . . 0.0 113.218 177.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -109.18 102.49 11.44 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.42 -2.13 36.9 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.559 -178.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' A' ' 8' ' ' ASN . 18.6 mtmt -79.29 122.25 26.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.546 175.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.506 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 3.4 t30 74.81 100.68 0.07 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.775 0.798 . . . . 0.0 110.053 -174.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -137.76 21.94 2.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.737 -177.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.62 58.74 4.71 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.382 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.93 124.89 52.85 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.367 -0.234 . . . . 0.0 110.367 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.481 ' HB2' ' H ' ' A' ' 13' ' ' GLY . 0.7 OUTLIER 54.94 -95.47 0.05 Allowed 'General case' 0 CA--C 1.538 0.484 0 O-C-N 123.979 0.799 . . . . 0.0 111.85 -179.538 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.481 ' H ' ' HB2' ' A' ' 12' ' ' SER . . . -148.19 59.55 0.46 Allowed Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.454 ' HA ' ' HB3' ' A' ' 17' ' ' ASN . . . -70.78 -11.07 60.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.474 0.178 . . . . 0.0 111.386 -178.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -75.4 -41.16 56.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.983 0.421 . . . . 0.0 110.124 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.416 HG23 HG13 ' A' ' 87' ' ' VAL . 1.7 mt -71.64 -39.62 69.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.056 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.454 ' HB3' ' HA ' ' A' ' 14' ' ' ALA . 1.5 t-20 -66.17 -32.02 73.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.681 178.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -62.17 -43.84 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 177.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.483 ' O ' HG13 ' A' ' 23' ' ' ILE . 11.3 t80 -62.54 -48.36 79.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 177.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.63 -45.64 85.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 111.293 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.36 -35.9 90.87 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.489 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -66.97 -38.96 87.03 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.465 0.172 . . . . 0.0 111.465 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 19' ' ' TYR . 14.1 mt -63.17 -43.14 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.436 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -62.81 -40.19 96.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.722 177.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.2 m -70.26 -34.24 72.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.924 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.637 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -61.09 -40.57 94.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.007 0.432 . . . . 0.0 110.752 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.474 HG23 ' HB3' ' A' ' 73' ' ' ALA . 37.7 mt -66.18 -37.91 80.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.641 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.634 ' HG2' ' H ' ' A' ' 33' ' ' ASP . 1.4 tm-20 -72.98 -20.79 60.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.905 176.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -74.24 -7.94 54.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.215 0.531 . . . . 0.0 110.7 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.644 ' HD2' ' HB2' ' A' ' 76' ' ' LEU . 2.5 mmtm -114.21 -27.16 7.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.034 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.749 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 2.5 m-85 -123.37 85.55 2.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.41 174.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -47.49 90.6 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.989 0.805 . . . . 0.0 112.612 -175.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.634 ' H ' ' HG2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER 53.24 17.64 1.06 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.016 0.926 . . . . 0.0 111.319 -176.544 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.749 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -81.36 -56.16 4.24 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.506 -177.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.921 ' HB2' ' HZ ' ' A' ' 98' ' ' PHE . 1.2 p -69.9 -27.75 65.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.567 0.699 . . . . 0.0 109.93 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.3 m -80.54 82.68 6.5 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.575 177.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' A' ' 38' ' ' ALA . 0.1 OUTLIER -81.76 -117.78 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.392 -178.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.424 ' H ' ' HB3' ' A' ' 37' ' ' TYR . . . -172.68 147.36 1.77 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.514 0.197 . . . . 0.0 110.983 177.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.18 -52.46 4.64 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.358 -0.449 . . . . 0.0 113.128 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -80.13 151.53 29.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.774 0.321 . . . . 0.0 111.559 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.525 HG23 ' HB2' ' A' ' 99' ' ' LYS . 1.0 OUTLIER -131.87 153.12 50.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.103 176.218 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 117.32 12.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.879 0.371 . . . . 0.0 110.959 -178.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 m -84.9 104.8 15.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.789 0.328 . . . . 0.0 110.465 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.0 mt -93.49 114.0 26.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.239 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.619 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.6 ttm180 -74.52 96.16 2.89 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.2 pt -117.59 113.78 43.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.382 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.525 ' HG2' HD21 ' A' ' 55' ' ' LEU . 3.2 tttt -97.91 111.72 23.92 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.548 HD13 ' HD2' ' A' ' 91' ' ' PHE . 2.2 mt -94.8 124.86 39.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.0 0.428 . . . . 0.0 110.888 -174.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.61 152.92 95.23 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.011 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.08 -20.17 44.57 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.177 2.584 . . . . 0.0 113.472 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -83.82 -4.03 58.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.699 0.285 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.81 44.45 4.83 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.608 176.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.431 ' O ' ' HG3' ' A' ' 53' ' ' MET . 0.0 OUTLIER -139.39 142.39 37.53 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 177.221 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.83 96.83 7.12 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.777 0.322 . . . . 0.0 110.151 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.525 HD21 ' HG2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -73.01 -35.17 66.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.023 0.44 . . . . 0.0 110.14 -178.71 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.446 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 34.3 t0 -126.62 101.84 6.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.217 177.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 tt -127.99 111.36 24.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.06 0.457 . . . . 0.0 110.294 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -153.79 141.8 13.94 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 -177.821 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.443 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 20.6 Cg_exo -64.8 124.68 13.52 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.459 2.106 . . . . 0.0 111.865 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.15 -54.57 4.93 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -162.07 144.61 9.87 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 177.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 157.32 -130.03 2.53 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.501 -178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.6 121.59 25.79 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.551 0.215 . . . . 0.0 110.56 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -46.72 -45.0 20.98 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 123.596 2.864 . . . . 0.0 113.431 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.59 -52.11 65.75 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.716 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.455 ' HG ' ' CE2' ' A' ' 98' ' ' PHE . 9.2 tp -66.22 -42.64 88.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 4.0 m -63.51 -42.19 98.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.595 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -65.87 -39.8 91.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.07 91.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.291 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . . . -67.32 -46.31 73.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.723 176.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.411 HD11 ' HD3' ' A' ' 59' ' ' PRO . 1.4 mt -55.06 -46.09 75.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.012 0.434 . . . . 0.0 111.026 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.85 88.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.728 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.474 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -81.98 -41.57 20.58 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -176.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.67 -32.96 72.14 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.63 61.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.169 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.644 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 1.9 mt -90.62 -25.43 20.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 110.566 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.637 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -64.44 138.64 58.52 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.636 -174.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 81.1 2.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.331 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.478 HG12 HG23 ' A' ' 23' ' ' ILE . 2.3 mp -71.44 126.17 91.76 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.552 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.7 Cg_exo -66.8 177.66 3.34 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 123.08 2.52 . . . . 0.0 112.007 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 142.92 31.09 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.271 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.448 ' HA ' ' HD2' ' A' ' 83' ' ' PRO . 6.5 Cg_endo -48.68 118.27 3.28 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.401 2.734 . . . . 0.0 112.223 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' A' ' 82' ' ' PRO . 18.2 Cg_endo -63.57 -29.01 70.12 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.089 2.526 . . . . 0.0 113.313 -175.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.22 159.48 40.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.853 0.358 . . . . 0.0 111.278 -177.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -62.76 -34.75 77.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.12 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.19 -37.9 81.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.416 HG13 HG23 ' A' ' 16' ' ' ILE . 2.2 t -74.63 -26.87 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.866 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.3 OUTLIER -61.59 -37.94 85.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.498 178.23 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -72.44 -35.33 68.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.2 t -70.38 -54.54 18.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.579 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.548 ' HD2' HD13 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -71.01 9.23 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -174.628 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.504 ' HD2' ' O ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -75.04 -25.4 58.68 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.111 -0.368 . . . . 0.0 111.227 177.444 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -173.74 34.64 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.667 0.27 . . . . 0.0 111.628 -177.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -102.54 113.05 66.08 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 120.823 0.344 . . . . 0.0 110.691 176.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.619 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 20.1 Cg_exo -72.83 144.72 39.41 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.052 2.501 . . . . 0.0 111.542 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.471 ' HA ' HD23 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -91.69 142.87 27.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -174.869 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.83 97.19 9.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.454 173.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.921 ' HZ ' ' HB2' ' A' ' 35' ' ' SER . 57.6 t80 -79.3 107.4 12.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.454 0.645 . . . . 0.0 110.596 -177.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.596 ' HG2' ' HD2' ' A' ' 100' ' ' PRO . 5.3 ttpt -150.03 148.89 26.09 Favored Pre-proline 0 C--N 1.311 -1.086 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.596 ' HD2' ' HG2' ' A' ' 99' ' ' LYS . 23.8 Cg_exo -31.61 119.64 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 124.202 3.268 . . . . 0.0 112.564 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.536 ' O ' ' HB2' ' A' ' 102' ' ' HIS . 2.5 p80 -45.19 138.56 3.86 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.121 -0.945 . . . . 0.0 113.219 -168.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.536 ' HB2' ' O ' ' A' ' 101' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.278 0 CA-C-N 113.994 -1.457 . . . . 0.0 110.062 -174.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.909 0 CA-C-O 120.284 0.087 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.62 94.14 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.977 0.798 . . . . 0.0 111.786 178.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -146.6 -173.78 4.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.992 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.35 7.97 69.15 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.294 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.9 t30 65.57 22.11 11.74 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.122 0.487 . . . . 0.0 110.808 -179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.07 51.8 2.03 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.303 0.573 . . . . 0.0 111.016 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.93 57.86 1.33 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.034 179.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -138.99 144.84 39.09 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.377 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -159.54 144.11 15.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.119 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.26 -176.02 38.36 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.478 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -104.43 -44.17 4.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.171 0.51 . . . . 0.0 109.944 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 m -80.88 145.41 31.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.225 172.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 114.78 -21.27 14.12 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.076 -173.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.44 -23.69 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 174.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -46.53 76.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.575 174.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.0 mt -64.01 -43.15 97.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.403 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -60.48 -33.21 72.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.862 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.465 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 17.4 t-20 -74.69 -47.77 29.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.687 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -68.27 -37.73 81.01 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.205 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.94 -27.19 64.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.432 0.634 . . . . 0.0 109.459 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.73 -27.86 73.57 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.052 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 18' ' ' ASN . 50.8 mm-40 -63.4 -33.31 75.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.049 0.452 . . . . 0.0 109.966 176.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.432 HD12 HG23 ' A' ' 79' ' ' ILE . 7.8 mm -77.26 -42.27 30.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.656 176.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.459 ' NZ ' ' HB3' ' A' ' 24' ' ' LYS . 4.7 mtpm? -58.88 -53.85 53.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.338 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -59.75 -33.08 71.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.657 0.265 . . . . 0.0 111.292 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.3 -50.13 71.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.637 HG23 ' HB1' ' A' ' 73' ' ' ALA . 74.7 mt -68.3 -32.62 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.206 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.434 ' HG3' ' CD2' ' A' ' 101' ' ' HIS . 0.0 OUTLIER -65.55 -20.66 66.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.951 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.44 14.86 28.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 177.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.422 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -148.89 33.3 0.76 Allowed 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.14 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.448 ' HB2' ' HB3' ' A' ' 34' ' ' ALA . 14.3 p90 -70.17 -29.4 66.28 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 113.756 -1.566 . . . . 0.0 112.676 -167.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 1.7 m-85 71.1 -72.24 0.12 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -169.155 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -149.84 24.94 0.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.708 0.766 . . . . 0.0 109.905 168.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.521 ' O ' ' HA ' ' A' ' 100' ' ' PRO . . . -73.8 -29.83 62.39 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.073 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.872 ' HA ' ' HB2' ' A' ' 101' ' ' HIS . 73.6 m -77.56 -17.69 57.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.188 0.518 . . . . 0.0 110.731 -178.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m -109.46 -73.27 0.69 Allowed 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.06 -177.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 37.23 -107.57 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.891 0.877 . . . . 0.0 112.618 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -154.56 -119.32 0.03 OUTLIER 'General case' 0 C--O 1.227 -0.129 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -130.5 36.41 2.3 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.426 -176.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.54 ' O ' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -88.56 176.92 6.93 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.537 0.208 . . . . 0.0 110.572 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.448 ' HA ' ' HB3' ' A' ' 99' ' ' LYS . 23.7 m -153.95 115.83 4.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.56 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.5 OUTLIER -121.16 177.97 4.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.147 -178.571 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.8 m -148.89 122.24 9.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.202 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.491 HD11 ' HB1' ' A' ' 70' ' ' ALA . 18.8 mt -94.23 113.55 25.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.569 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.691 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 tmm_? -78.15 89.44 4.25 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 175.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -102.37 136.67 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.051 -173.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.61 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -114.63 100.15 8.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.319 177.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 tp -86.34 126.41 34.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.202 -174.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.658 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -76.92 167.74 34.12 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.246 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.658 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 6.7 Cg_endo -52.66 -37.96 75.71 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.162 2.575 . . . . 0.0 113.657 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -74.01 -10.7 59.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.948 0.404 . . . . 0.0 111.406 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 97.73 11.58 50.03 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.032 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ptm -98.94 146.71 25.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.472 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -77.48 109.59 11.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.77 0.319 . . . . 0.0 110.306 -179.09 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.61 -21.23 30.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.374 0.607 . . . . 0.0 109.893 178.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.61 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 48.1 t0 -149.3 135.55 19.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.106 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.7 tt -153.89 113.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.221 0.534 . . . . 0.0 110.372 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.6 tttp -151.85 132.61 7.54 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.084 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.53 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 50.8 Cg_exo -55.44 125.41 19.05 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.713 2.275 . . . . 0.0 112.214 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -77.31 -53.53 7.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.965 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -174.39 151.76 13.3 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.038 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.56 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 149.88 -101.67 0.22 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.808 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.576 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 12.6 t70 -141.42 129.44 12.06 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 -178.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -56.33 -40.65 83.3 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.362 2.708 . . . . 0.0 113.432 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.07 -38.3 63.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.928 0.394 . . . . 0.0 110.984 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -66.58 -50.21 63.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.551 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.654 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.3 m -69.45 -21.91 63.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.509 -177.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -67.74 -50.55 56.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.15 -31.47 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.377 177.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.491 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -56.44 -46.19 80.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.45 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 6.4 mt -62.69 -41.31 99.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.893 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.04 -44.89 79.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.018 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.637 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.91 -43.01 94.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.03 -24.56 66.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 0.0 110.952 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 -28.49 46.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.565 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.422 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -86.99 -20.14 27.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.884 -178.074 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -92.59 149.75 21.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.498 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 pttp -105.73 135.41 47.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.422 0.63 . . . . 0.0 111.051 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.432 HG23 HD12 ' A' ' 23' ' ' ILE . 3.5 mp -110.09 130.84 22.4 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.288 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -84.67 164.47 12.2 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.143 1.895 . . . . 0.0 112.21 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 ttmm -70.88 126.87 92.19 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.933 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.488 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 52.4 Cg_exo -54.66 117.73 4.31 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.947 2.432 . . . . 0.0 112.048 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -70.31 -62.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.571 2.181 . . . . 0.0 112.832 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.65 138.81 32.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.748 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.516 ' HA ' ' HB3' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -61.05 -30.79 70.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 0.0 111.046 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.09 -52.76 63.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 177.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -69.12 -35.51 68.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.046 0.45 . . . . 0.0 110.404 178.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.516 ' HB3' ' HA ' ' A' ' 85' ' ' GLN . 0.9 OUTLIER -56.39 -43.87 79.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.873 179.682 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 33.7 mt-10 -75.61 -35.01 60.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.171 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.3 t -64.98 -43.16 96.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.106 0.479 . . . . 0.0 109.885 178.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -83.69 41.83 0.81 Allowed 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.077 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 1.1 tpmp? -101.82 -23.98 14.11 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.121 0.486 . . . . 0.0 109.738 175.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -158.98 59.89 0.42 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.052 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.12 95.78 49.16 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.595 -176.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.691 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.1 Cg_exo -72.96 137.72 27.18 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 123.012 2.474 . . . . 0.0 111.511 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.38 153.66 17.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.77 133.49 40.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.191 173.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.439 ' CZ ' HG21 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -131.82 103.06 6.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.519 0.676 . . . . 0.0 111.25 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.625 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.3 OUTLIER -139.95 167.6 17.78 Favored Pre-proline 0 C--N 1.315 -0.912 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.389 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.625 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 9.5 Cg_endo -45.45 107.03 0.1 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.059 2.506 . . . . 0.0 110.626 175.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.872 ' HB2' ' HA ' ' A' ' 35' ' ' SER . 4.2 m-70 -62.5 130.62 45.98 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 113.99 -1.459 . . . . 0.0 113.298 -163.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.954 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.196 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.777 0.322 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.406 ' HB3' ' H ' ' A' ' 3' ' ' PHE . 3.7 tm-20 -127.19 -83.27 0.61 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.327 -179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.406 ' H ' ' HB3' ' A' ' 2' ' ' GLU . 5.4 m-85 62.74 15.04 7.78 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.627 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 68.37 5.25 41.82 Favored Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 116.258 -0.428 . . . . 0.0 113.303 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.97 -47.33 0.66 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.614 0.766 . . . . 0.0 111.556 -177.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.43 -1.0 57.3 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.567 0.222 . . . . 0.0 111.306 -178.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp 71.46 -63.05 0.44 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.666 0.786 . . . . 0.0 111.235 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -154.67 -52.11 0.09 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.0 t30 67.15 -67.95 0.16 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.436 0.695 . . . . 0.0 112.171 176.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.89 64.59 3.2 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.392 -0.683 . . . . 0.0 111.392 -177.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.72 105.18 12.12 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.857 0.36 . . . . 0.0 111.179 -176.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.12 -20.89 18.28 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.04 0.448 . . . . 0.0 109.931 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 66.07 48.61 63.87 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.278 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.84 68.82 0.66 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.45 0.643 . . . . 0.0 110.739 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -167.22 -49.08 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.225 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.478 ' HA ' HG23 ' A' ' 87' ' ' VAL . 0.7 OUTLIER -87.05 -40.69 14.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.835 176.179 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -60.5 -26.73 67.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.864 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.32 -52.53 53.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.654 0.264 . . . . 0.0 110.56 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.559 ' CE2' HD11 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -64.03 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.583 178.109 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . -64.28 -39.85 94.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.233 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.52 -33.46 87.31 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.733 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.89 -38.77 86.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.587 0.232 . . . . 0.0 111.214 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.559 HD11 ' CE2' ' A' ' 19' ' ' TYR . 5.8 mt -62.51 -36.03 72.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.003 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.519 ' HB3' ' NE2' ' A' ' 101' ' ' HIS . 3.6 mmtp -58.46 -50.18 74.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.147 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.51 -32.74 58.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.539 -178.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.489 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.89 -47.94 83.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.14 0.495 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.419 HG23 ' CB ' ' A' ' 73' ' ' ALA . 84.1 mt -73.92 -31.39 30.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.804 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -29.38 70.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.912 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.97 -8.54 59.0 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.987 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.49 36.34 4.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.79 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.567 ' HB2' ' H ' ' A' ' 35' ' ' SER . 14.0 p90 -72.53 123.53 23.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.482 0.658 . . . . 0.0 110.956 -178.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.447 ' HB3' ' H ' ' A' ' 33' ' ' ASP . 0.9 OUTLIER -74.43 -77.08 0.12 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 174.43 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.447 ' H ' ' HB3' ' A' ' 32' ' ' TYR . 0.5 OUTLIER -128.7 26.33 5.6 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.455 -1.702 . . . . 0.0 107.101 166.374 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.443 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . . . -69.96 -56.29 7.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 113.841 -1.527 . . . . 0.0 111.283 -173.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.567 ' H ' ' HB2' ' A' ' 31' ' ' PHE . 16.3 m -69.23 -16.73 63.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.163 0.506 . . . . 0.0 110.679 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 m -97.0 -11.94 23.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.764 -172.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.607 ' O ' ' HG2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -83.15 43.48 0.87 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -174.855 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.8 67.38 0.1 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.473 0.654 . . . . 0.0 112.471 -175.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -172.39 1.04 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.674 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.149 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mmtp -138.64 163.56 31.76 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.849 0.357 . . . . 0.0 111.196 -177.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.39 162.37 22.9 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.205 175.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.71 107.1 1.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.712 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.2 m -87.59 135.01 33.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.786 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -127.0 126.73 43.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.82 0.343 . . . . 0.0 110.692 -179.033 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.784 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 2.7 ttm-85 -80.61 97.92 7.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.715 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 46' ' ' ILE . 1.6 pt -105.91 149.07 9.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.33 0.586 . . . . 0.0 111.528 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.573 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 22.1 mttp -127.1 109.4 11.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.932 177.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -95.39 150.14 20.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.395 0.617 . . . . 0.0 111.694 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.512 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -111.58 161.06 27.14 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.366 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.493 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.1 Cg_endo -60.05 -17.07 43.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.23 2.62 . . . . 0.0 113.169 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.9 0.43 51.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.791 0.329 . . . . 0.0 111.125 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.62 29.54 52.02 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.869 177.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -132.88 143.98 49.87 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.446 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -89.49 112.48 23.66 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.846 0.355 . . . . 0.0 110.352 -178.887 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.512 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.0 OUTLIER -74.4 -30.87 62.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.224 -179.532 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.573 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.8 t70 -133.32 139.52 46.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.176 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.428 HG12 HD22 ' A' ' 71' ' ' LEU . 5.6 tt -155.78 106.78 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.293 0.568 . . . . 0.0 109.652 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -124.03 133.75 24.89 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.133 -172.492 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 24.7 Cg_exo -60.47 125.52 17.59 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.461 2.107 . . . . 0.0 111.613 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' ' HB2' ' A' ' 45' ' ' ARG . 9.4 mm-40 -87.66 -68.57 0.75 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.703 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.75 133.74 4.31 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.272 -0.877 . . . . 0.0 111.291 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 154.45 -159.16 28.71 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.176 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 66' ' ' LEU . 12.0 t70 -78.18 125.87 84.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.469 0.176 . . . . 0.0 110.76 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 53.3 Cg_exo -53.6 -37.32 83.09 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.923 2.415 . . . . 0.0 112.82 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.09 -43.58 42.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.213 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.406 ' HB3' ' HB3' ' A' ' 63' ' ' ASP . 37.1 tp -65.99 -47.09 75.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.884 0.373 . . . . 0.0 110.388 179.274 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.577 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.3 m -62.58 -44.63 95.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.492 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 1.2 tp60 -61.16 -41.51 96.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.907 178.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.53 -31.56 72.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.022 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.83 -44.93 68.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 0.1 OUTLIER -62.31 -41.92 98.94 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.836 0.35 . . . . 0.0 110.576 178.696 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -46.57 87.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.957 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.419 ' CB ' HG23 ' A' ' 27' ' ' ILE . . . -65.15 -43.43 91.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.545 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.36 75.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.36 -26.08 55.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.712 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.05 -33.14 33.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.409 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.489 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -81.93 166.95 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.028 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.22 115.39 26.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.1 178.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 28.5 mm -87.31 125.63 65.14 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.959 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.55 124.86 17.28 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.414 2.076 . . . . 0.0 111.715 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.524 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -55.86 145.48 52.57 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.665 -178.386 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.43 ' HG3' ' HZ ' ' A' ' 91' ' ' PHE . 12.4 Cg_exo -34.64 99.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 125.129 3.886 . . . . 0.0 114.774 -175.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -79.07 -37.52 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.529 2.153 . . . . 0.0 111.251 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.503 ' O ' HG12 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -99.42 146.69 26.05 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.012 177.235 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -76.83 -40.08 49.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 111.074 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.9 -27.59 64.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.924 0.393 . . . . 0.0 111.249 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.503 HG12 ' O ' ' A' ' 84' ' ' SER . 0.5 OUTLIER -71.0 -23.7 23.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.618 -178.208 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.519 ' HA ' ' CZ ' ' A' ' 91' ' ' PHE . 89.6 t80 -65.4 -34.03 77.35 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.103 0.477 . . . . 0.0 110.467 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.53 -18.35 60.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.563 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 52.5 t -85.93 -53.4 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.938 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.519 ' CZ ' ' HA ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -81.25 9.87 6.36 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -173.182 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -61.61 -30.18 70.52 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.573 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 10.8 t30 -160.09 72.53 0.5 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.529 -1.214 . . . . 0.0 108.643 171.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.425 ' CB ' ' HA ' ' A' ' 91' ' ' PHE . . . -113.17 84.58 7.38 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.943 -175.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.784 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 21.2 Cg_exo -73.46 110.78 3.14 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.065 2.51 . . . . 0.0 111.71 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.63 151.7 19.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.823 -175.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.712 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 29.2 t70 -103.76 100.94 10.77 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 176.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.53 135.06 33.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.227 0.536 . . . . 0.0 111.251 -176.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.26 144.01 49.17 Favored Pre-proline 0 C--N 1.323 -0.584 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.701 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.607 ' HG2' ' O ' ' A' ' 37' ' ' TYR . 91.4 Cg_exo -46.03 100.07 0.04 OUTLIER 'Trans proline' 0 N--CA 1.475 0.419 0 C-N-CA 124.061 3.174 . . . . 0.0 112.061 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.519 ' NE2' ' HB3' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -63.14 135.25 57.06 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -167.545 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.317 -0.808 0 CA-C-N 113.785 -1.552 . . . . 0.0 107.637 169.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 120.937 0.398 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -143.64 96.93 2.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.596 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -100.56 86.76 3.21 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.932 0.396 . . . . 0.0 111.276 -175.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.66 76.83 2.06 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 174.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -59.81 116.24 3.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.732 0.301 . . . . 0.0 111.289 -174.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -51.91 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.132 -178.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.24 152.96 18.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.14 177.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -87.76 130.28 34.9 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 175.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.47 ' HB3' ' H ' ' A' ' 10' ' ' GLY . 4.6 t-20 -83.56 -101.19 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.419 -173.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.47 ' H ' ' HB3' ' A' ' 9' ' ' ASN . . . 79.1 -70.42 2.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.779 -0.725 . . . . 0.0 111.507 -175.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -167.96 -98.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.605 0.362 . . . . 0.0 110.154 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.8 -34.42 30.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.125 0.488 . . . . 0.0 110.717 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 80.12 -60.37 4.47 Favored Glycine 0 CA--C 1.519 0.295 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.962 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.6 -53.11 25.8 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -57.35 -42.96 83.01 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.99 0.424 . . . . 0.0 111.494 -177.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.493 ' H ' HG13 ' A' ' 16' ' ' ILE . 0.8 OUTLIER -74.01 -42.08 52.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.234 -178.783 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -36.91 85.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.076 0.465 . . . . 0.0 110.554 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -69.91 -37.96 76.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.336 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -42.61 99.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.672 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.42 82.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 0.0 111.111 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.26 -33.79 56.04 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.815 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -28.29 69.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.693 0.283 . . . . 0.0 111.432 -176.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.469 ' O ' HG13 ' A' ' 27' ' ' ILE . 4.0 mt -70.76 -35.5 60.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.71 0.291 . . . . 0.0 110.485 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -59.87 -47.62 85.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.74 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -35.54 75.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.886 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -47.71 81.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.397 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 23' ' ' ILE . 53.6 mt -64.59 -36.72 78.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.943 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -64.2 -38.57 91.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 110.962 176.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.1 m -73.15 -10.42 59.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.164 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.749 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.23 -8.79 15.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.2 -178.608 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.61 ' HB3' ' O ' ' A' ' 33' ' ' ASP . 0.2 OUTLIER -66.27 132.29 48.07 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 176.721 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -57.62 -56.99 14.8 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 -175.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.857 ' HB3' ' HA ' ' A' ' 36' ' ' SER . 33.3 t70 -91.35 151.4 20.87 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 165.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -47.27 -58.85 3.64 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.198 0.454 . . . . 0.0 111.282 -172.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.727 ' HB3' ' HB2' ' A' ' 102' ' ' HIS . 0.1 OUTLIER -84.44 -37.57 21.25 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.96 170.68 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.857 ' HA ' ' HB3' ' A' ' 33' ' ' ASP . 49.5 m 74.58 -47.39 0.63 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.096 -173.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.481 ' O ' ' HB2' ' A' ' 35' ' ' SER . 9.5 m-85 -138.23 -165.28 1.77 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 176.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.677 ' HA ' ' HG2' ' A' ' 100' ' ' PRO . . . -173.11 169.28 4.64 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.812 175.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.76 36.28 93.1 Favored Glycine 0 N--CA 1.452 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.869 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.46 151.06 38.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.856 0.36 . . . . 0.0 111.026 -177.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -127.3 128.35 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.642 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.21 105.25 6.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.093 0.473 . . . . 0.0 111.473 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -89.27 118.25 28.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.435 -179.362 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.61 127.37 54.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.36 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.82 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 1.1 tpp180 -80.1 111.89 16.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.9 pt -120.97 137.58 54.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.285 0.564 . . . . 0.0 110.771 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -122.93 111.07 16.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.354 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.6 tp -94.95 143.67 26.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.17 0.51 . . . . 0.0 111.701 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.633 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -103.39 166.67 11.37 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.542 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.633 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 36.2 Cg_endo -64.17 -11.51 28.04 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.168 1.912 . . . . 0.0 111.782 177.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 81' ' ' LYS . 24.5 t70 -85.52 -13.38 49.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.309 176.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.03 -15.39 63.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.349 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.53 149.16 36.73 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.975 0.417 . . . . 0.0 110.607 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.26 105.55 17.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.887 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.424 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.2 OUTLIER -68.25 -30.63 69.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.561 . . . . 0.0 109.85 179.204 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -135.24 131.45 36.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.65 176.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -156.49 105.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.172 0.511 . . . . 0.0 109.656 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 7.0 ptpp? -154.77 148.18 18.48 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.906 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.66 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 10.4 Cg_exo -73.0 129.61 14.44 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.032 2.488 . . . . 0.0 111.663 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.36 -70.56 0.72 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.9 127.34 6.96 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.674 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 164.45 -138.8 5.47 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.592 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.535 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 11.5 t70 -122.78 129.97 24.81 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 53.6 Cg_exo -55.76 -34.4 90.85 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.131 2.554 . . . . 0.0 113.68 -176.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.77 -43.3 18.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.751 0.31 . . . . 0.0 110.76 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.681 HD11 ' HD3' ' A' ' 100' ' ' PRO . 0.2 OUTLIER -58.82 -52.25 66.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.569 178.445 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.66 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 11.9 m -63.06 -36.76 84.65 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.846 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 4.7 tp60 -63.53 -43.24 97.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.72 0.295 . . . . 0.0 110.787 177.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.12 99.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.069 0.461 . . . . 0.0 110.221 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.86 95.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.048 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 66.9 mt -57.56 -49.55 76.02 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.835 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.45 -41.62 94.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.168 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.62 69.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.263 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.03 75.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.842 0.353 . . . . 0.0 111.142 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -68.21 -23.85 64.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.176 0.512 . . . . 0.0 110.891 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.749 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -103.54 3.32 34.59 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.57 179.468 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.45 146.28 45.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.182 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.79 86.25 7.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.87 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.3 109.02 62.73 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.926 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -72.1 159.88 48.83 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.983 2.455 . . . . 0.0 112.762 -174.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 51' ' ' ASP . 2.3 ttmt -69.75 117.55 54.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.499 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 81' ' ' LYS . 32.6 Cg_exo -65.48 109.76 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.764 2.31 . . . . 0.0 112.81 -175.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -82.72 -40.44 0.12 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.468 2.112 . . . . 0.0 111.852 178.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.3 120.37 20.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.309 177.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -65.12 -31.9 73.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.924 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.43 79.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.006 0.432 . . . . 0.0 110.643 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.402 ' HA ' HG23 ' A' ' 16' ' ' ILE . 28.6 t -68.48 -48.98 69.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.544 177.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -37.65 83.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 -179.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.9 mm-40 -71.67 -33.08 68.54 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.622 -178.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.25 -38.0 40.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.193 0.52 . . . . 0.0 110.132 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -79.47 13.7 1.89 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.596 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -70.43 -22.84 62.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.172 175.744 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -161.58 77.84 0.54 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.154 174.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -129.83 80.84 70.6 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.264 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.82 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.4 Cg_exo -73.18 141.24 32.15 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.747 2.298 . . . . 0.0 111.742 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.3 mt -97.96 129.43 44.86 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.291 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.509 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 31.8 t70 -97.85 95.21 7.37 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 172.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -104.32 139.49 39.23 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.492 0.663 . . . . 0.0 112.14 -169.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.38 150.1 48.92 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 114.466 -1.243 . . . . 0.0 107.808 171.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.681 ' HD3' HD11 ' A' ' 66' ' ' LEU . 14.5 Cg_endo -57.95 104.28 0.17 Allowed 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 121.915 1.743 . . . . 0.0 110.817 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.437 ' HD1' ' HA ' ' A' ' 101' ' ' HIS . 0.1 OUTLIER -53.38 111.58 0.73 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.766 -1.107 . . . . 0.0 113.493 -166.392 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.727 ' HB2' ' HB3' ' A' ' 35' ' ' SER . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-N 114.343 -1.299 . . . . 0.0 108.905 173.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.662 0.268 . . . . 0.0 110.483 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 2.4 pm0 -71.48 101.62 2.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.217 178.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' A' ' 3' ' ' PHE . 1.2 m-30 -88.99 -55.39 3.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.524 -177.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 63.98 -97.73 0.23 Allowed Glycine 0 C--N 1.332 0.327 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -177.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.435 ' HB3' ' H ' ' A' ' 6' ' ' THR . 13.7 t30 -151.66 -128.33 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 173.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.497 ' HB ' ' H ' ' A' ' 7' ' ' LYS . 0.2 OUTLIER 53.91 -97.42 0.07 Allowed 'General case' 0 C--O 1.237 0.417 0 C-N-CA 122.962 0.505 . . . . 0.0 112.104 175.831 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.497 ' H ' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER 74.09 -58.6 0.58 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.542 0.737 . . . . 0.0 110.913 -178.013 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.47 -173.94 3.95 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 57.45 51.89 9.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.173 0.511 . . . . 0.0 110.952 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -90.45 87.98 1.42 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.358 -178.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.74 119.91 37.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.675 0.274 . . . . 0.0 111.068 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.43 71.52 8.44 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.362 0.601 . . . . 0.0 110.38 178.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 169.46 -23.2 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.491 -177.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.07 134.6 49.3 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 123.574 0.22 . . . . 0.0 110.809 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 72.68 -47.93 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.762 0.825 . . . . 0.0 111.983 -178.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.438 ' H ' HG13 ' A' ' 16' ' ' ILE . 6.9 mt -59.72 -45.81 94.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.843 0.354 . . . . 0.0 110.972 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.88 -37.49 84.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.664 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -70.23 -47.23 62.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.751 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.465 ' CB ' HG21 ' A' ' 87' ' ' VAL . 5.3 t80 -58.44 -49.04 78.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.992 179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.28 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.259 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.81 -49.1 10.84 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.179 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -56.81 -39.28 73.89 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 122.72 0.408 . . . . 0.0 111.658 -177.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.497 HG12 HD12 ' A' ' 79' ' ' ILE . 76.0 mt -57.72 -43.8 84.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.995 0.426 . . . . 0.0 110.61 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.451 ' HA ' ' HZ ' ' A' ' 98' ' ' PHE . 31.8 mttp -65.09 -47.77 76.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.927 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.47 -39.35 79.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.392 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.493 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -66.53 -46.63 75.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.047 0.451 . . . . 0.0 110.677 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.45 HD12 ' CE2' ' A' ' 98' ' ' PHE . 1.7 mt -62.96 -50.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.287 -178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.508 ' HG3' ' HB3' ' A' ' 35' ' ' SER . 0.0 OUTLIER -64.13 -20.82 66.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.037 -176.659 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 60.1 m -67.45 -11.84 58.84 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.77 0.319 . . . . 0.0 111.049 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HE2' ' HA ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -113.17 9.81 18.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.091 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.459 ' CG ' ' HB3' ' A' ' 34' ' ' ALA . 1.9 m-30 -113.24 144.61 42.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.479 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -115.4 -75.94 0.58 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.017 0.437 . . . . 0.0 110.312 177.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -96.13 0.42 51.29 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 121.827 0.822 . . . . 0.0 110.455 178.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' HB3' ' CG ' ' A' ' 31' ' ' PHE . . . -77.93 -36.08 49.79 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.017 -1.447 . . . . 0.0 110.3 174.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.508 ' HB3' ' HG3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -75.84 -18.01 59.62 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.792 176.764 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.6 m -97.61 45.61 1.03 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.323 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.438 ' HD2' HD13 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -135.64 37.65 2.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.953 -178.041 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.05 -14.2 33.67 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.655 -174.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.69 -17.03 76.31 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.075 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt -115.19 146.47 41.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.989 0.423 . . . . 0.0 110.398 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.28 168.7 11.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.602 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 4.7 t -152.89 57.64 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.049 0.452 . . . . 0.0 110.522 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.431 HG23 ' HA ' ' A' ' 97' ' ' ASP . 1.8 m -69.36 114.13 7.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.809 0.338 . . . . 0.0 110.219 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.33 124.28 49.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.805 -176.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.576 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -77.63 97.32 5.06 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 174.567 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 95' ' ' PRO . 1.1 pt -121.41 145.54 27.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -174.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HD3' HD11 ' A' ' 55' ' ' LEU . 2.5 tttp -127.94 115.34 18.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.384 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.489 HD13 ' HD2' ' A' ' 91' ' ' PHE . 15.9 mt -94.54 125.02 38.92 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.741 -175.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.468 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -75.26 148.1 83.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.392 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.715 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 2.4 Cg_endo -48.87 -28.4 13.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.899 3.066 . . . . 0.0 113.621 -176.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.46 7.49 9.71 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.32 46.65 9.86 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.378 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.468 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.51 139.12 26.57 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.165 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.63 122.57 24.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.857 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.506 HD11 ' HD3' ' A' ' 47' ' ' LYS . 1.2 pp -93.81 -31.16 14.48 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -129.48 138.44 51.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.634 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.2 tt -159.15 106.9 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.232 0.539 . . . . 0.0 110.101 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -145.43 139.98 15.47 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.904 -175.331 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 14.9 Cg_exo -66.23 120.67 7.84 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.604 2.203 . . . . 0.0 111.196 176.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -102.53 -49.52 3.83 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.421 -175.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -145.9 111.2 0.57 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.278 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 160.3 -161.95 32.92 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.117 -1.04 . . . . 0.0 112.587 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 14.8 t70 -78.75 129.85 72.48 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 120.752 0.311 . . . . 0.0 110.689 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 31.2 Cg_exo -62.25 -34.03 79.34 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.071 2.514 . . . . 0.0 112.929 -176.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -79.62 -41.76 26.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.92 0.391 . . . . 0.0 110.627 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.438 HD13 ' HD2' ' A' ' 37' ' ' TYR . 31.2 tp -59.21 -52.88 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.687 178.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 60.3 m -73.22 -15.13 61.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.716 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -72.68 -39.07 67.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.179 0.514 . . . . 0.0 109.873 174.283 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.86 62.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.379 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.402 ' HA ' ' HZ ' ' A' ' 31' ' ' PHE . . . -60.84 -38.01 84.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.198 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 3.0 mt -61.92 -41.41 97.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.139 0.495 . . . . 0.0 110.278 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.71 71.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.809 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.97 91.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.47 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.66 -30.45 71.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.869 0.366 . . . . 0.0 111.343 -178.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -32.79 58.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.352 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -31.69 36.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.681 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.493 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -70.74 157.61 37.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.981 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.29 94.14 4.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.605 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.497 HD12 HG12 ' A' ' 23' ' ' ILE . 33.1 mm -76.33 122.09 86.11 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.803 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.7 153.79 76.62 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.681 2.254 . . . . 0.0 111.675 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.619 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 0.9 OUTLIER -74.53 147.0 84.43 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 175.815 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.619 ' HD2' ' HG2' ' A' ' 81' ' ' LYS . 10.6 Cg_endo -52.96 117.03 3.32 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.928 2.419 . . . . 0.0 111.955 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.465 ' HD2' HG11 ' A' ' 87' ' ' VAL . 5.8 Cg_endo -78.67 -64.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.236 1.958 . . . . 0.0 112.404 -177.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 48.2 m -95.49 159.94 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.153 0.501 . . . . 0.0 111.133 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.9 -27.91 68.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.667 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.35 -50.78 71.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.575 -177.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.465 HG11 ' HD2' ' A' ' 83' ' ' PRO . 4.1 p -74.76 -22.66 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.288 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -62.04 -35.95 80.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.289 0.566 . . . . 0.0 110.657 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.648 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.65 -18.0 55.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.138 -178.944 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.06 -53.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.927 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.715 ' HZ ' ' HA ' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -61.82 -19.03 62.11 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -171.184 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.648 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 8.8 ptpt -73.22 -6.54 46.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.59 -178.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -162.19 50.92 0.2 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.967 0.413 . . . . 0.0 111.15 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -132.84 105.49 12.74 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.228 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.576 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 3.0 Cg_exo -73.77 139.9 28.41 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.707 2.271 . . . . 0.0 110.923 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.56 127.53 35.89 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.066 0.46 . . . . 0.0 111.366 -175.053 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.431 ' HA ' HG23 ' A' ' 43' ' ' THR . 46.6 t0 -93.07 94.35 8.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 173.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.552 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 0.3 OUTLIER -88.18 137.75 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.652 -171.658 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -137.73 112.51 9.06 Favored Pre-proline 0 C--N 1.319 -0.752 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.8 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -45.56 127.73 9.88 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 123.608 2.872 . . . . 0.0 113.752 -173.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.482 ' HB2' ' CD ' ' A' ' 28' ' ' GLU . 1.8 m80 -75.93 79.56 2.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.121 -175.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.165 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.871 173.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -106.65 -57.5 2.05 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 69.25 -57.95 0.52 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 124.072 0.858 . . . . 0.0 111.332 179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.431 ' H ' ' H ' ' A' ' 5' ' ' ASN . . . 165.03 0.31 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -178.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.431 ' H ' ' H ' ' A' ' 4' ' ' GLY . 5.3 m120 64.45 19.05 11.66 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.299 0.639 . . . . 0.0 110.809 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.87 72.03 8.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.859 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.1 tttt -139.39 138.2 36.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.012 -177.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -81.26 74.65 8.25 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.49 166.13 10.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.71 -174.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.0 -142.66 15.52 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.643 -176.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 15' ' ' ASP . . . -140.16 96.48 3.06 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.649 0.261 . . . . 0.0 110.722 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.06 -21.97 60.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.399 179.181 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.01 135.83 23.34 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 173.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 76.39 -32.39 0.2 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.56 0.744 . . . . 0.0 111.08 -173.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 11.2 t0 -61.37 -50.85 71.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.898 0.38 . . . . 0.0 110.364 176.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.564 HG12 HG22 ' A' ' 87' ' ' VAL . 22.9 mt -65.28 -41.07 90.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.688 177.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -59.41 -45.08 92.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.778 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -67.38 -48.57 67.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.938 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.545 ' HD2' ' HG2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -60.52 -34.78 74.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.624 -176.802 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.5 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.99 -40.54 96.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.961 0.41 . . . . 0.0 110.995 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.34 -29.22 62.43 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.891 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -62.67 -37.22 85.55 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 122.148 0.179 . . . . 0.0 111.008 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.5 HD12 ' HA ' ' A' ' 20' ' ' ALA . 12.8 mt -58.39 -44.8 89.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.022 0.439 . . . . 0.0 110.717 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -64.3 -45.42 88.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.084 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -72.45 -31.12 65.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.428 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.39 -45.95 83.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.038 0.447 . . . . 0.0 111.081 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.498 HG23 ' HB1' ' A' ' 73' ' ' ALA . 57.9 mt -60.84 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.123 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.486 ' HG2' ' HA ' ' A' ' 32' ' ' TYR . 2.1 tt0 -74.25 -21.29 59.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.563 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.8 m -67.53 -17.23 64.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.055 0.455 . . . . 0.0 109.816 175.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.7 -47.97 4.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.496 172.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.443 ' CA ' ' HB3' ' A' ' 34' ' ' ALA . 3.8 m-30 -107.53 84.52 1.98 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.512 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.486 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -68.29 -90.77 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.874 0.368 . . . . 0.0 111.455 -176.93 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.451 ' H ' ' HB3' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -80.39 6.06 13.23 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 122.455 1.122 . . . . 0.0 109.496 174.805 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.443 ' HB3' ' CA ' ' A' ' 31' ' ' PHE . . . -76.03 -31.86 59.08 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 112.937 -1.938 . . . . 0.0 109.988 170.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.442 ' O ' ' HB3' ' A' ' 100' ' ' PRO . 60.4 m -77.51 -18.08 57.37 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.16 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 33' ' ' ASP . 0.5 OUTLIER -68.09 95.58 0.57 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.38 179.024 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -123.26 -68.51 0.87 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.397 -174.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.448 ' HB3' ' HG2' ' A' ' 40' ' ' LYS . . . -174.8 -160.15 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.708 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -94.03 51.78 2.22 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 172.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.448 ' HG2' ' HB3' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -93.92 166.41 12.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.19 0.519 . . . . 0.0 111.684 -174.052 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.3 152.07 36.47 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.829 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.504 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -163.56 90.33 0.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.156 0.503 . . . . 0.0 110.937 -179.601 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.762 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -70.87 116.88 11.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.409 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.2 mt -99.06 118.13 35.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.712 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.2 ttt180 -80.53 101.14 8.95 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -120.26 137.24 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.36 0.6 . . . . 0.0 111.588 -175.331 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.631 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -129.8 109.23 10.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.107 -0.952 . . . . 0.0 108.605 174.839 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.51 144.07 36.65 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.529 0.681 . . . . 0.0 111.627 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -100.48 161.5 23.8 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.577 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.652 ' HG3' ' HB2' ' A' ' 88' ' ' TYR . 36.4 Cg_exo -57.45 -14.19 15.62 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.041 2.494 . . . . 0.0 112.699 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.22 -11.89 59.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.107 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.2 34.64 23.06 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.886 -179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.47 144.44 47.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.787 0.327 . . . . 0.0 110.238 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.489 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -100.09 97.21 8.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.8 178.917 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -29.8 63.62 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.438 -177.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -129.07 127.09 40.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.319 176.793 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.64 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.0 OUTLIER -159.08 108.77 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.339 -175.925 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -158.0 151.38 18.95 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -72.45 119.81 6.35 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.926 2.417 . . . . 0.0 111.963 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.762 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 74.3 mt-10 -82.37 -65.06 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.143 0.496 . . . . 0.0 109.766 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -143.77 123.6 2.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.384 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.504 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 173.84 -178.02 45.89 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.375 -0.917 . . . . 0.0 112.795 -178.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.34 129.63 90.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.37 -47.82 25.3 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.939 2.426 . . . . 0.0 112.649 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.26 -46.88 75.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.192 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.96 -55.31 36.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.122 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.657 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.8 m -63.3 -31.74 72.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.045 -177.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -63.83 -46.34 85.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.77 0.319 . . . . 0.0 110.592 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.19 -34.2 74.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.534 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.3 78.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.227 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 51.8 mt -59.96 -44.43 94.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.101 0.477 . . . . 0.0 110.56 178.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.75 73.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.827 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.11 -45.34 89.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.75 -178.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.14 -35.34 80.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.906 0.384 . . . . 0.0 111.155 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -68.57 -32.84 73.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.545 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.3 mp -80.48 -32.04 37.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.856 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.11 130.37 43.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.659 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -88.38 84.68 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.503 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.423 HG21 ' HE2' ' A' ' 91' ' ' PHE . 3.0 mt -70.84 132.18 87.07 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.602 -179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.545 ' HG2' ' HD2' ' A' ' 19' ' ' TYR . 18.9 Cg_endo -61.83 125.26 16.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.747 2.298 . . . . 0.0 112.083 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.5 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -75.33 132.39 76.19 Favored Pre-proline 0 N--CA 1.443 -0.798 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.417 -178.832 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 60.7 Cg_exo -52.92 115.71 2.44 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.959 2.44 . . . . 0.0 112.712 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 4.6 Cg_endo -81.14 -69.51 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.95 2.434 . . . . 0.0 111.214 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.67 146.65 49.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.596 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.23 -26.76 68.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.855 0.36 . . . . 0.0 111.446 -175.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.07 -27.44 69.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.108 178.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.564 HG22 HG12 ' A' ' 16' ' ' ILE . 13.6 t -77.26 -32.2 18.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.652 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -61.92 -35.5 78.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.06 0.457 . . . . 0.0 110.225 178.936 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.517 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -67.74 -27.17 66.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.171 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.3 t -68.24 -57.32 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.442 ' HD1' ' HB3' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -85.5 3.35 40.79 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -176.554 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.517 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -63.82 -23.94 67.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.915 0.388 . . . . 0.0 110.411 178.469 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -163.62 78.22 0.41 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.749 174.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.442 ' HB3' ' HD1' ' A' ' 91' ' ' PHE . . . -135.47 84.25 34.96 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.144 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.712 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 4.3 Cg_exo -74.4 104.68 1.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.786 2.324 . . . . 0.0 110.629 177.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.82 140.67 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.21 -174.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 4.8 t70 -87.45 112.35 22.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.845 177.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -86.81 111.37 20.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.076 0.465 . . . . 0.0 110.595 -177.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 100' ' ' PRO . 4.6 mtmm -105.02 138.58 19.55 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.555 176.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.442 ' HB3' ' O ' ' A' ' 35' ' ' SER . 76.3 Cg_exo -53.23 109.45 0.36 Allowed 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.338 2.692 . . . . 0.0 112.951 -177.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -61.39 143.18 56.25 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.928 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.926 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.863 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.604 0.24 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 3' ' ' PHE . 0.0 OUTLIER -70.14 -54.52 12.57 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 2.0 m-85 74.6 -47.14 0.62 Allowed 'General case' 0 N--CA 1.472 0.644 0 O-C-N 124.034 0.834 . . . . 0.0 111.209 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 158.09 -149.76 20.27 Favored Glycine 0 N--CA 1.438 -1.225 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 -175.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -138.52 136.73 36.4 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 117.679 0.74 . . . . 0.0 110.84 175.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.04 108.21 18.15 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.94 151.33 39.09 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.993 0.425 . . . . 0.0 110.668 -178.212 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -151.6 132.3 14.02 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.104 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -142.9 17.43 1.96 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.968 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.99 -101.64 0.9 Allowed Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.396 -176.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.95 115.54 4.49 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 175.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -69.46 0.28 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.39 -178.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 145.32 -89.77 0.16 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 119.996 -1.097 . . . . 0.0 113.609 174.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.24 -41.05 71.63 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -173.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -50.52 73.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.648 0.261 . . . . 0.0 111.228 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.431 ' HA ' ' HD2' ' A' ' 19' ' ' TYR . 7.9 mt -62.78 -44.87 99.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.985 -179.147 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -66.07 -32.83 74.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.962 0.41 . . . . 0.0 110.853 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -69.65 -50.22 46.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.681 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.431 ' HD2' ' HA ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -62.87 -34.63 77.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.008 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.55 87.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.062 0.458 . . . . 0.0 110.246 175.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.54 -33.02 75.73 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.234 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -60.69 -36.02 77.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.867 0.365 . . . . 0.0 110.78 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.453 HD12 HG23 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -62.61 -40.72 89.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.41 0.624 . . . . 0.0 109.404 177.837 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 13.1 mttt -66.06 -48.06 72.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.298 178.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 m -54.22 -36.73 63.8 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.798 0.332 . . . . 0.0 111.6 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.85 86.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.011 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -77.18 -42.11 31.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.439 -177.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 59.2 mt-10 -55.33 -38.62 68.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.677 -177.484 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.64 15.34 14.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.886 -176.104 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HD3' ' HB3' ' A' ' 76' ' ' LEU . 67.9 mttt -151.4 33.48 0.57 Allowed 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.788 ' HB2' ' H ' ' A' ' 35' ' ' SER . 21.8 p90 -58.59 -49.82 76.08 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 113.887 -1.506 . . . . 0.0 113.316 -167.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER 67.77 -70.1 0.13 Allowed 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.357 0.41 . . . . 0.0 110.334 -171.263 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -136.63 20.27 3.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.741 0.781 . . . . 0.0 110.424 175.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.65 ' O ' ' HB3' ' A' ' 100' ' ' PRO . . . -80.6 -56.97 3.8 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.681 177.071 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.788 ' H ' ' HB2' ' A' ' 31' ' ' PHE . 43.8 m -66.67 -16.67 64.37 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -174.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -20.46 61.14 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -170.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -127.45 64.52 1.34 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.587 ' HA ' ' HB2' ' A' ' 100' ' ' PRO . . . -70.5 121.77 18.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.067 172.32 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 132.58 -28.9 3.35 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -175.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.787 ' HB3' HD22 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -83.81 159.49 21.4 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 174.283 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.5 139.01 45.15 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.64 ' HB2' HD23 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -145.87 107.99 4.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.985 0.421 . . . . 0.0 111.151 -176.082 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.4 m -74.97 112.91 11.68 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.2 mt -103.69 122.48 45.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.934 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.568 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -78.63 102.95 8.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.888 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.64 HD11 ' HB2' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -101.29 110.33 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.279 -176.933 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.557 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -101.98 98.39 8.61 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.93 177.814 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -100.04 131.24 46.12 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.269 0.557 . . . . 0.0 111.07 -174.419 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.406 ' HB3' ' HG2' ' A' ' 53' ' ' MET . . . -75.85 153.66 85.01 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.691 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.06 -27.01 34.6 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.186 2.591 . . . . 0.0 113.296 -178.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -77.35 -5.07 48.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.244 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.15 42.21 6.75 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.642 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.406 ' HG2' ' HB3' ' A' ' 49' ' ' ALA . 1.0 OUTLIER -127.82 149.39 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 177.753 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.477 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -81.43 105.64 12.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.39 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.454 ' HG ' ' HB3' ' A' ' 47' ' ' LYS . 1.5 pp -88.19 -24.28 23.34 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.504 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 26.0 t0 -154.68 111.09 3.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.977 179.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.418 HD12 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -121.51 106.6 18.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.02 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -133.66 129.12 20.27 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -172.863 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 12.6 Cg_exo -66.68 127.07 16.44 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.557 2.171 . . . . 0.0 110.919 175.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -90.28 -65.77 0.99 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.251 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.67 145.82 13.98 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.639 -0.791 . . . . 0.0 111.72 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 151.82 -136.16 5.35 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.866 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.51 119.21 59.41 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -53.53 -41.16 75.65 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.988 2.459 . . . . 0.0 113.064 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.67 -48.79 53.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.671 0.272 . . . . 0.0 110.933 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.787 HD22 ' HB3' ' A' ' 40' ' ' LYS . 7.8 tp -59.09 -46.39 88.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.699 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.5 m -61.4 -42.03 98.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.266 -177.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -40.2 94.96 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.723 0.296 . . . . 0.0 110.822 179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.05 -38.75 82.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.577 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.23 -36.53 82.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.023 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 45.3 mt -60.63 -45.1 95.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.696 177.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.1 -43.89 90.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.13 -48.71 77.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.115 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.5 -24.45 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.401 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -67.19 -38.13 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.012 0.434 . . . . 0.0 110.426 178.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 76' ' ' LEU . 1.0 OUTLIER -91.69 -17.75 24.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.707 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.27 138.17 58.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.189 -177.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 78' ' ' LYS . 0.4 OUTLIER -82.25 86.36 6.67 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.005 178.638 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.453 HG23 HD12 ' A' ' 23' ' ' ILE . 30.5 mm -82.61 121.02 77.74 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.865 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -82.07 146.78 14.52 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.485 2.124 . . . . 0.0 112.219 -176.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.456 ' HG2' ' H ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -61.64 147.91 87.8 Favored Pre-proline 0 N--CA 1.446 -0.655 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.418 178.597 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.93 112.64 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.653 2.902 . . . . 0.0 113.524 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.53 -26.97 13.48 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.701 2.267 . . . . 0.0 112.284 -177.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.8 152.62 38.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.107 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -63.38 -34.98 78.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.862 -176.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.58 67.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.065 0.46 . . . . 0.0 110.77 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 88.1 t -68.37 -32.2 54.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.096 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.415 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -59.77 -42.11 92.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.986 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.42 ' H ' ' HG2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -79.81 -39.1 31.51 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.044 -0.262 . . . . 0.0 111.488 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.2 t -70.22 -46.46 71.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CD2' HD22 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -63.54 -13.95 46.42 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.586 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 18.1 mtmt -69.13 -5.83 24.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.861 0.362 . . . . 0.0 110.695 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -169.2 69.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -127.51 84.37 63.56 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.529 -174.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.568 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 11.5 Cg_exo -74.24 105.8 2.1 Favored 'Trans proline' 0 CA--C 1.53 0.322 0 C-N-CA 123.158 2.572 . . . . 0.0 111.8 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.64 ' HB2' HD11 ' A' ' 46' ' ' ILE . 2.7 mp -89.57 150.67 22.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.997 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.459 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 1.7 t0 -92.59 97.26 10.7 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -68.37 128.16 35.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.197 0.522 . . . . 0.0 111.418 -175.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.84 112.02 18.79 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.345 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.65 ' HB3' ' O ' ' A' ' 34' ' ' ALA . 51.1 Cg_exo -56.5 138.74 85.5 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 123.141 2.56 . . . . 0.0 111.89 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -88.9 154.17 20.46 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.021 -175.265 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 38' ' ' ALA . 7.8 t-80 . . . . . 0 C--O 1.246 0.915 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.48 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 120.733 0.301 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -111.33 155.3 23.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.423 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -109.96 -42.6 4.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 174.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 71.91 -134.01 21.4 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.696 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.52 67.12 1.15 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -46.69 85.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.139 -175.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.2 tttt 55.52 63.28 2.12 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.541 0.526 . . . . 0.0 110.621 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -59.38 121.6 11.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.477 -179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -146.36 -88.14 0.1 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.239 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.89 139.03 4.43 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.524 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.629 ' H ' HG22 ' A' ' 90' ' ' VAL . . . -93.07 163.77 13.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.673 0.273 . . . . 0.0 111.097 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.53 -48.85 24.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.105 -177.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.441 ' HA2' ' HB ' ' A' ' 16' ' ' ILE . . . 167.07 -99.2 0.15 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.427 -0.892 . . . . 0.0 112.677 179.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 62.42 -89.85 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.967 0.507 . . . . 0.0 111.475 -177.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -76.16 -16.81 59.79 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.334 0.588 . . . . 0.0 110.81 178.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.441 ' HB ' ' HA2' ' A' ' 13' ' ' GLY . 49.5 mm -69.13 -26.36 31.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.115 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -57.64 -47.1 83.17 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -65.17 -44.81 87.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.715 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -44.43 96.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.701 178.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.53 95.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.806 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.49 -43.87 97.51 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.981 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.493 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -66.79 -38.52 86.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.535 0.207 . . . . 0.0 111.04 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.493 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 63.6 mt -65.32 -48.55 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.866 0.365 . . . . 0.0 110.576 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -63.37 -24.93 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.142 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 m -78.77 -45.43 21.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.439 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.96 -40.81 73.77 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.238 0.542 . . . . 0.0 110.879 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.631 HG23 ' HB3' ' A' ' 73' ' ' ALA . 5.8 mt -61.69 -46.18 97.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.56 -21.13 63.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.522 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -68.59 -11.76 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.873 0.368 . . . . 0.0 110.664 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.46 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 3.1 mptp? -103.41 -47.07 4.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.028 176.049 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.758 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 4.6 m-85 -104.97 69.7 0.88 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.157 176.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.459 ' C ' ' H ' ' A' ' 34' ' ' ALA . 1.1 p90 -55.07 117.07 3.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.881 -175.027 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 t0 64.01 -1.25 0.7 Allowed 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 115.025 -0.989 . . . . 0.0 112.763 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.758 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -81.67 -47.85 12.46 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.089 173.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.78 -22.81 49.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.456 178.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.78 84.81 7.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.508 -175.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.71 ' HB2' HD13 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -96.38 -144.17 0.28 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.042 175.913 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.791 ' HA ' ' HG3' ' A' ' 100' ' ' PRO . . . -161.87 144.02 11.47 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.561 -0.163 . . . . 0.0 110.561 177.053 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.11 46.45 92.67 Favored Glycine 0 C--N 1.332 0.31 0 O-C-N 123.535 0.522 . . . . 0.0 113.097 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.685 ' HB3' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -148.25 137.1 21.76 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -121.06 107.69 12.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.776 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.604 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.3 OUTLIER -104.95 114.6 28.91 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.978 0.418 . . . . 0.0 111.04 -177.678 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -86.9 99.12 11.62 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.182 176.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.2 mt -85.39 113.03 21.38 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.868 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -74.65 112.67 11.08 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.254 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.572 HG13 ' HA ' ' A' ' 95' ' ' PRO . 1.3 pt -131.88 123.05 50.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.815 -171.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 mtmm -102.68 98.93 8.89 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.898 HD23 ' HD2' ' A' ' 91' ' ' PHE . 4.9 tp -93.62 113.07 25.08 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.045 0.45 . . . . 0.0 110.343 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.64 150.08 87.36 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.226 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.802 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 16.3 Cg_endo -58.28 -6.94 3.3 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 123.206 2.604 . . . . 0.0 113.086 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.91 -4.11 56.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.734 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.4 62.65 2.04 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.54 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.99 139.58 9.95 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.517 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -88.93 104.84 17.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.87 0.367 . . . . 0.0 111.0 -178.065 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.09 -37.94 28.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.155 0.502 . . . . 0.0 109.966 177.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -124.51 121.95 36.26 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.108 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.436 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 4.2 tt -143.35 110.35 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.879 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -140.79 143.39 31.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.356 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.536 ' HG3' HD22 ' A' ' 71' ' ' LEU . 8.8 Cg_exo -70.54 103.73 1.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.246 1.964 . . . . 0.0 111.33 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -70.33 -49.67 47.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.055 0.455 . . . . 0.0 110.025 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -173.71 137.74 4.21 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.843 177.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.604 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 168.61 -102.7 0.19 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.429 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -143.01 128.15 9.97 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -55.48 -37.22 95.14 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.799 2.333 . . . . 0.0 112.907 -177.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.99 -48.95 16.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.71 HD13 ' HB2' ' A' ' 37' ' ' TYR . 34.6 tp -63.33 -45.04 93.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.459 ' O ' HD23 ' A' ' 71' ' ' LEU . 4.1 m -65.39 -43.89 89.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.795 -175.468 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -57.33 -49.81 74.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.742 0.306 . . . . 0.0 110.739 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.66 -29.17 70.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.662 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.16 -51.58 8.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.532 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.536 HD22 ' HG3' ' A' ' 59' ' ' PRO . 0.9 OUTLIER -65.31 -39.22 92.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.318 -176.135 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.566 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . . . -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.1 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.631 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -74.06 -33.45 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.427 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.0 -28.89 68.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 72' ' ' ALA . 8.9 mttm -71.75 -22.78 61.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.071 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -100.95 -19.97 15.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.174 -177.548 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.41 132.94 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.562 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 91.23 8.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.518 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.457 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 38.7 mm -72.22 121.64 85.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.359 179.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 29.5 Cg_exo -64.11 153.19 77.64 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.823 2.349 . . . . 0.0 112.042 -177.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 135.25 88.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 116.21 3.03 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.124 2.55 . . . . 0.0 113.179 -173.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -79.64 -50.01 0.07 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.655 2.237 . . . . 0.0 112.157 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.85 156.8 23.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.772 0.32 . . . . 0.0 110.863 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.89 -27.48 57.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.932 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.587 ' O ' HG23 ' A' ' 90' ' ' VAL . . . -60.76 -40.77 93.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.69 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.2 t -61.9 -42.55 95.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 177.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.548 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 0.7 OUTLIER -58.79 -32.26 69.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.524 178.472 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.514 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 2.7 mm-40 -75.91 -30.23 58.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.885 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.629 HG22 ' H ' ' A' ' 11' ' ' ALA . 5.4 t -92.42 -53.42 8.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -173.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.898 ' HD2' HD23 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -61.72 -13.11 20.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -168.707 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.3 ptpt -75.33 -13.63 60.43 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.952 -177.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -169.21 22.16 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.616 ' HB3' HG12 ' A' ' 90' ' ' VAL . . . -121.38 123.64 27.57 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 121.752 -0.592 . . . . 0.0 111.27 177.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.868 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.3 Cg_exo -72.7 156.78 53.06 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.191 2.594 . . . . 0.0 112.204 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.75 132.79 40.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.419 -175.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 112.64 19.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.305 174.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -106.35 122.78 46.95 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.296 0.569 . . . . 0.0 110.843 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.545 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -150.66 163.32 24.38 Favored Pre-proline 0 C--N 1.312 -1.024 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.499 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.791 ' HG3' ' HA ' ' A' ' 38' ' ' ALA . 5.9 Cg_exo -40.07 106.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.647 2.898 . . . . 0.0 112.324 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 16.1 p80 -67.28 153.15 44.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.479 -173.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 9.0 p80 . . . . . 0 C--O 1.248 0.983 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.098 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 2' ' ' GLU . . . . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 1' ' ' ALA . 2.0 mp0 70.27 -57.91 0.56 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.486 172.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.66 164.52 36.75 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.54 84.83 0.53 Allowed Glycine 0 N--CA 1.451 -0.304 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -80.33 48.17 0.99 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.156 0.503 . . . . 0.0 111.296 -174.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.14 -43.06 22.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.506 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 56.95 -137.75 1.0 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.35 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -116.25 85.28 2.27 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -92.59 122.33 34.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.745 -0.662 . . . . 0.0 112.155 -171.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.46 -41.98 0.6 Allowed Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.787 176.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -91.73 96.68 10.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.965 0.412 . . . . 0.0 110.737 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.55 117.86 13.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.16 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -123.16 -139.63 5.51 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.193 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -129.67 -55.13 1.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.002 0.429 . . . . 0.0 110.942 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.23 -20.63 63.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.984 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.562 ' HA ' HG22 ' A' ' 87' ' ' VAL . 13.9 mt -67.01 -47.8 81.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.922 0.391 . . . . 0.0 110.365 174.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -34.05 70.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.112 0.482 . . . . 0.0 109.926 177.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -63.81 -39.74 94.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.881 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.43 -40.34 82.24 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.083 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.86 -49.67 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.266 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.78 -31.58 73.21 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.052 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -34.12 70.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.606 0.241 . . . . 0.0 110.676 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 60.0 mt -66.39 -41.44 88.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.13 83.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.821 176.107 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 m -66.79 -38.14 85.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 0.0 110.569 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.04 -34.95 77.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.214 0.531 . . . . 0.0 110.779 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 5.5 mt -83.32 -56.25 6.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.626 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HA ' ' HB2' ' A' ' 31' ' ' PHE . 43.6 mt-10 -75.48 -22.32 57.32 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.595 -170.184 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -80.42 8.48 7.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.698 -0.627 . . . . 0.0 110.288 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.98 12.39 11.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 172.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.592 ' CG ' ' HB3' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -108.87 137.61 46.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.508 -177.248 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.4 ' HB3' ' H ' ' A' ' 33' ' ' ASP . 2.3 t80 -85.6 -83.81 0.17 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.814 0.34 . . . . 0.0 111.004 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.4 ' H ' ' HB3' ' A' ' 32' ' ' TYR . 12.6 t0 -78.31 -18.36 55.32 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.546 0.688 . . . . 0.0 111.371 -176.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.616 ' HA ' ' CD2' ' A' ' 37' ' ' TYR . . . -77.28 -29.4 53.82 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.873 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -17.8 63.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.002 0.43 . . . . 0.0 110.797 177.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 m -109.41 20.94 17.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.961 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.616 ' CD2' ' HA ' ' A' ' 34' ' ' ALA . 5.1 m-30 -96.45 173.26 7.45 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.677 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.435 ' HA ' ' HG2' ' A' ' 100' ' ' PRO . . . -172.72 166.53 5.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.833 175.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.81 43.4 91.73 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.333 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.2 mmtt -137.94 158.92 43.34 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.26 138.7 40.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.885 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.44 93.38 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.159 0.504 . . . . 0.0 111.65 -176.694 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.6 m -76.49 113.78 14.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.216 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.672 HD11 ' HB2' ' A' ' 98' ' ' PHE . 0.0 OUTLIER -113.22 125.62 54.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 177.491 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.927 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 12.4 ttm105 -78.48 98.35 6.03 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.023 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -105.33 155.32 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.256 -176.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.67 103.08 5.11 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.004 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -81.82 138.43 35.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.973 0.415 . . . . 0.0 110.991 -177.904 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.545 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.82 163.76 17.43 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.638 176.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.545 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 33.3 Cg_endo -62.43 -11.89 25.07 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.348 2.032 . . . . 0.0 112.062 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.41 -4.35 59.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.912 177.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.96 10.55 84.86 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.606 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.46 154.12 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.744 0.307 . . . . 0.0 110.473 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.36 102.07 14.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.093 179.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.478 HD11 ' HB2' ' A' ' 49' ' ' ALA . 0.8 OUTLIER -65.2 -42.78 93.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.143 0.497 . . . . 0.0 110.248 -179.6 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -128.31 144.26 51.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.2 tt -158.1 106.34 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.365 0.602 . . . . 0.0 109.408 177.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -135.15 123.63 15.82 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.032 -174.029 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.592 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 21.6 Cg_exo -65.64 120.7 7.93 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.974 2.449 . . . . 0.0 112.15 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -61.86 1.86 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -166.63 -176.71 37.95 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.029 177.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.5 -89.22 0.43 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 -178.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 64' ' ' PRO . 13.1 t70 -133.91 110.29 12.01 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 120.78 0.324 . . . . 0.0 110.518 176.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 63' ' ' ASP . 11.0 Cg_endo -55.99 -36.08 95.43 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 122.717 2.278 . . . . 0.0 112.787 -177.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.84 -53.09 12.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.307 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.915 0.388 . . . . 0.0 110.9 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.592 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 8.5 m -64.74 -42.59 95.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.606 -178.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -68.82 -33.59 74.09 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.933 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.54 69.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 178.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.07 71.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 15.2 mt -61.16 -37.06 81.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.788 0.327 . . . . 0.0 111.14 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.27 -40.93 77.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.873 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.13 74.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.035 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.56 -26.91 68.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.383 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -78.05 -22.74 48.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mt -99.39 -11.4 21.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.501 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.11 125.69 27.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.278 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.91 99.14 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.812 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -112.89 124.72 31.11 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.616 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.7 168.41 19.5 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.55 2.167 . . . . 0.0 112.651 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 1.5 ttmt -66.92 127.73 93.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 7.0 Cg_endo -50.86 110.84 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.31 2.673 . . . . 0.0 112.577 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.74 -27.86 12.16 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.62 2.214 . . . . 0.0 111.457 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.5 ' HB2' HG23 ' A' ' 87' ' ' VAL . 0.6 OUTLIER -107.54 120.05 41.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.154 177.865 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -60.99 -32.07 71.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.12 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.68 78.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.92 0.391 . . . . 0.0 110.913 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.562 HG22 ' HA ' ' A' ' 16' ' ' ILE . 91.0 t -66.6 -44.62 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -62.41 -43.38 98.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.969 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.831 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 3.3 mm-40 -58.05 -32.52 68.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.31 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.23 -58.2 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.452 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -65.43 -18.94 65.71 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.831 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.73 -13.81 61.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.816 0.341 . . . . 0.0 110.918 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -153.08 46.78 0.69 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 110.695 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.82 101.3 11.7 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.812 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.927 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.6 Cg_exo -72.45 131.75 18.03 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.848 2.365 . . . . 0.0 111.53 -178.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.66 146.03 25.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.251 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -97.07 96.71 8.66 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.967 175.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.672 ' HB2' HD11 ' A' ' 44' ' ' LEU . 48.9 t80 -73.16 108.86 6.29 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.419 -173.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.69 135.73 25.43 Favored Pre-proline 0 C--N 1.315 -0.902 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.435 ' HG2' ' HA ' ' A' ' 38' ' ' ALA . 51.1 Cg_exo -36.19 126.04 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.913 3.075 . . . . 0.0 113.388 -175.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.414 ' HB3' ' OE2' ' A' ' 28' ' ' GLU . 12.4 p80 -58.3 159.39 6.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.3 -173.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.172 -0.918 . . . . 0.0 109.297 174.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 70.51 -64.36 0.37 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.891 0.744 . . . . 0.0 110.893 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -100.65 138.43 37.71 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.68 24.93 4.14 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.075 -177.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 61.2 t30 54.22 76.16 0.25 Allowed 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.867 0.467 . . . . 0.0 111.774 177.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.483 HG21 ' HB2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -76.99 62.56 2.15 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.205 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.69 141.18 29.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.881 -177.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -86.6 68.94 10.31 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.371 0.605 . . . . 0.0 109.512 175.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -76.06 -28.73 57.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.277 -176.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -105.19 -127.09 5.89 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.336 174.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.7 43.49 2.73 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.973 0.416 . . . . 0.0 110.494 178.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.83 88.04 2.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.748 -178.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.35 -5.75 8.48 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.976 -176.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.81 -31.21 64.48 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.836 0.35 . . . . 0.0 111.812 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -75.99 -54.38 6.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.054 0.454 . . . . 0.0 110.428 178.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.412 HG23 ' CE2' ' A' ' 91' ' ' PHE . 3.2 mt -65.34 -48.06 84.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.447 -175.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -63.36 -37.89 89.04 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -175.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -33.84 76.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.028 0.442 . . . . 0.0 110.413 178.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -73.67 -48.7 30.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.697 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.81 -34.19 77.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.993 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.14 -35.95 91.19 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.191 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -65.85 -42.56 90.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.845 0.355 . . . . 0.0 110.994 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.551 HD12 ' HA ' ' A' ' 20' ' ' ALA . 44.8 mt -57.93 -44.29 86.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.37 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.2 mttp -55.16 -44.27 75.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.541 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.55 -36.67 44.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.975 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.17 -38.31 79.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.677 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 23' ' ' ILE . 6.3 mt -65.43 -38.32 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.985 -178.003 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -19.28 62.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.415 177.095 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -68.99 -23.64 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.149 0.5 . . . . 0.0 110.04 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 14.6 mmmt -96.18 -48.38 5.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.572 174.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.736 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 5.1 m-30 -89.97 89.16 7.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.852 176.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -60.56 86.52 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.855 0.359 . . . . 0.0 111.59 -176.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.4 t70 61.82 16.63 8.1 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.878 0.846 . . . . 0.0 110.623 -176.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.736 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -80.71 -42.41 21.98 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.926 178.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.56 -22.77 65.38 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.463 177.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.98 65.8 1.12 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.366 176.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.495 ' HD1' ' HA ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -99.7 -47.05 5.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.348 -173.643 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.549 ' H ' ' HG2' ' A' ' 100' ' ' PRO . . . 68.62 152.52 0.09 Allowed 'General case' 0 N--CA 1.464 0.246 0 O-C-N 124.092 0.87 . . . . 0.0 111.143 -177.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.9 -37.79 2.68 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.187 -0.53 . . . . 0.0 111.962 -176.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.3 129.65 39.32 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.521 HG23 ' HG2' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -121.99 145.33 48.23 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.8 106.49 4.26 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.693 -177.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.605 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 20.0 m -78.94 113.33 16.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.661 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -108.63 114.25 27.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.196 -176.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.872 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 21.8 ttm180 -79.42 89.07 5.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.7 pt -95.28 111.88 26.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.569 -172.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -93.94 99.44 11.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.37 177.191 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.712 ' HG ' HD23 ' A' ' 54' ' ' LEU . 4.9 mt -85.33 139.51 31.52 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.126 0.489 . . . . 0.0 111.379 -175.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.446 ' HB2' ' CD2' ' A' ' 55' ' ' LEU . . . -96.0 158.8 33.55 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.279 177.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.7 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 32.4 Cg_exo -56.0 -24.09 46.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.966 2.444 . . . . 0.0 112.564 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.434 ' HB2' ' HG2' ' A' ' 53' ' ' MET . 1.4 m-20 -75.19 -9.08 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.127 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 44.75 6.48 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.774 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.434 ' HG2' ' HB2' ' A' ' 51' ' ' ASP . 1.4 ptt? -150.81 142.46 23.63 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.712 HD23 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -88.54 101.58 14.08 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.352 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.446 ' CD2' ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -71.87 -37.22 70.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.1 t70 -123.73 100.13 6.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -111.57 106.18 20.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -113.94 119.96 39.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.611 -170.347 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.684 ' HG3' HD21 ' A' ' 71' ' ' LEU . 2.7 Cg_exo -71.51 110.9 2.98 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.694 2.263 . . . . 0.0 111.176 175.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.419 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 45.7 mt-10 -73.8 -49.21 26.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.209 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 173.22 172.9 39.17 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.472 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.8 -90.66 0.24 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -143.45 112.34 5.5 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.32 -35.01 95.44 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.953 2.435 . . . . 0.0 112.275 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.81 83.38 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.283 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.0 tp -88.05 -40.4 13.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.626 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.599 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.6 m -60.64 -55.07 37.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.298 -175.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HA ' HD12 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -61.99 -29.72 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.681 0.277 . . . . 0.0 111.455 -176.51 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.95 -44.06 27.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.928 0.394 . . . . 0.0 110.851 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.99 -28.97 69.94 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.464 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.684 HD21 ' HG3' ' A' ' 59' ' ' PRO . 91.2 mt -54.58 -44.84 73.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.652 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.6 -41.19 32.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.4 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -57.68 -50.05 74.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.99 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.19 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.85 0.357 . . . . 0.0 111.49 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.641 ' HG2' HD12 ' A' ' 54' ' ' LEU . 2.8 mtmt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 179.13 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.417 ' HB3' ' HE2' ' A' ' 30' ' ' LYS . 4.7 mp -94.6 -19.76 20.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.878 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.44 158.4 26.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.673 -175.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.03 73.84 5.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.685 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.433 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.9 mm -76.3 120.07 80.04 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.712 178.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 33.7 Cg_exo -63.58 171.56 6.74 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.594 2.196 . . . . 0.0 112.339 -177.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.445 ' HG3' ' HD2' ' A' ' 82' ' ' PRO . 1.1 tppt? -90.98 135.01 29.14 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 175.162 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.445 ' HD2' ' HG3' ' A' ' 81' ' ' LYS . 78.4 Cg_exo -44.16 111.57 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.396 2.731 . . . . 0.0 112.785 -178.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -62.99 -66.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.721 2.28 . . . . 0.0 112.25 -176.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.33 -179.37 3.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.778 0.323 . . . . 0.0 110.637 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -16.49 61.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.073 -177.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.31 -57.8 9.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.467 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.7 t -60.51 -37.57 75.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.63 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.7 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 29.3 t80 -54.0 -52.83 59.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.636 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.531 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 44.6 mm-40 -77.89 -40.81 38.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 111.534 -177.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.68 -52.56 22.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.981 -173.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.525 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 2.2 m-85 -72.69 -5.21 36.03 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -176.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 7.4 mtmt -65.92 -21.34 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 171.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.87 55.37 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.709 179.116 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.525 ' HB3' ' HA ' ' A' ' 91' ' ' PHE . . . -123.26 93.53 47.89 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -178.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.872 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.4 Cg_exo -73.73 140.08 28.78 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 123.013 2.475 . . . . 0.0 111.941 -178.185 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.35 135.08 55.14 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.57 -177.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.605 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 25.5 t0 -84.09 103.32 13.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 175.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.61 108.62 3.92 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.082 -175.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.521 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -119.9 116.82 32.69 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.536 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.549 ' HG2' ' H ' ' A' ' 38' ' ' ALA . 51.7 Cg_exo -36.06 114.5 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 124.103 3.202 . . . . 0.0 113.356 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -88.56 142.72 27.46 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.507 -178.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 . . . . . 0 C--O 1.247 0.971 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.069 -179.61 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 121.188 0.518 . . . . 0.0 109.915 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -101.52 134.05 45.22 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.317 -174.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -80.93 46.72 0.92 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.66 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 52.84 46.47 60.28 Favored Glycine 0 C--N 1.333 0.378 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.878 177.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -66.19 119.83 12.16 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.827 0.346 . . . . 0.0 110.539 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.98 84.92 0.22 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.767 -176.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.39 -77.7 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.521 178.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -110.72 -1.6 16.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.164 0.507 . . . . 0.0 109.897 175.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -120.01 168.85 10.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.968 177.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.25 -106.65 1.21 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.204 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -157.71 161.54 38.54 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.26 59.72 1.83 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.255 0.55 . . . . 0.0 111.004 -179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -178.68 38.06 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.002 -178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -101.33 142.84 32.14 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.484 -0.191 . . . . 0.0 110.484 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 65.22 -71.2 0.08 Allowed 'General case' 0 N--CA 1.469 0.485 0 O-C-N 123.92 0.763 . . . . 0.0 112.365 177.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -55.62 -50.81 64.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.899 0.38 . . . . 0.0 111.6 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -35.36 78.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.973 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -66.47 -48.36 70.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.73 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.45 80.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.298 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.19 -35.56 77.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.765 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.79 -37.12 88.28 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.571 177.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.06 -37.15 86.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.889 0.376 . . . . 0.0 110.632 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 36.1 mt -73.29 -40.07 56.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.409 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.72 -38.0 71.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.433 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.54 -42.81 28.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.867 0.365 . . . . 0.0 110.704 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.61 -47.31 86.07 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.406 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.446 HG23 ' HB1' ' A' ' 73' ' ' ALA . 4.6 mt -64.39 -39.33 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.311 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -21.18 64.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.459 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.44 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 4.3 m -96.53 17.81 15.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.117 0.484 . . . . 0.0 110.691 177.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 29' ' ' SER . 10.1 mmtt -150.81 32.14 0.62 Allowed 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -62.07 -41.85 98.59 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 113.487 -1.688 . . . . 0.0 113.013 -167.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 69.83 -66.38 0.27 Allowed 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -170.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -149.7 25.34 0.85 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.967 0.889 . . . . 0.0 109.999 170.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.56 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . . . -78.85 -18.91 53.23 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.359 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 p -65.89 -17.82 64.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.522 0.677 . . . . 0.0 110.291 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m -79.35 52.58 1.37 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.616 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.572 ' CD1' ' HB3' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -110.64 -154.12 0.53 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.974 -179.627 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.648 ' H ' ' HG3' ' A' ' 100' ' ' PRO . . . 73.33 118.59 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.736 0.814 . . . . 0.0 111.062 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.02 -22.78 34.1 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -171.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.723 ' HB2' HD23 ' A' ' 66' ' ' LEU . 23.2 mttm -117.65 150.95 38.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.1 -0.55 . . . . 0.0 110.38 176.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.17 149.09 39.27 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.42 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 33.4 t -152.37 116.6 4.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.041 0.448 . . . . 0.0 111.816 -178.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.896 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.9 m -76.03 121.43 22.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.42 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.7 mt -105.61 129.48 53.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 0.0 110.252 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HB3' ' HD2' ' A' ' 58' ' ' LYS . 8.6 ttt-85 -86.86 93.3 9.26 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.82 113.68 34.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.304 -173.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -101.01 100.86 11.53 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 175.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 91' ' ' PHE . 35.2 mt -93.15 130.03 38.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.947 -175.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.742 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -76.39 138.72 67.57 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 172.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.65 -17.82 18.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.349 2.699 . . . . 0.0 113.342 -175.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -81.32 -0.41 40.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.328 . . . . 0.0 111.174 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.67 63.88 1.52 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.564 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.742 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 1.8 ptp -159.68 135.61 8.68 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.648 HD21 HD13 ' A' ' 79' ' ' ILE . 0.0 OUTLIER -91.26 87.82 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.155 0.503 . . . . 0.0 110.043 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.477 ' HG ' ' N ' ' A' ' 56' ' ' ASP . 0.4 OUTLIER -76.59 -29.43 56.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.378 -178.661 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.477 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 29.7 t70 -130.52 92.52 3.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.38 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 tt -124.36 106.71 17.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.609 ' HD2' ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -134.3 142.6 43.6 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.47 -173.14 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.483 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 8.9 Cg_exo -69.82 132.29 22.92 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.055 2.503 . . . . 0.0 111.504 177.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -98.98 -76.58 0.53 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.418 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -133.14 145.69 17.67 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.467 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 135.69 -154.26 21.71 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.187 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -88.53 120.46 70.32 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -56.01 -27.27 63.31 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.99 2.46 . . . . 0.0 112.859 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.29 -42.64 75.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.706 0.289 . . . . 0.0 110.43 176.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.723 HD23 ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.716 174.736 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.559 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 8.8 m -63.07 -56.23 18.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.506 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -38.11 84.91 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.602 -174.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.56 ' HB1' ' HA ' ' A' ' 34' ' ' ALA . . . -65.53 -41.8 92.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.216 177.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.82 -38.98 87.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.021 177.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 17.8 mt -57.1 -51.35 69.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.929 0.395 . . . . 0.0 110.859 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.44 -44.01 92.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.033 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.446 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.74 -40.42 95.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.443 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.93 -33.8 76.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.73 0.3 . . . . 0.0 111.293 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.42 -26.32 60.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.01 0.433 . . . . 0.0 110.635 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.453 HD13 ' HA ' ' A' ' 76' ' ' LEU . 1.3 mm? -88.01 -31.92 19.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.701 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.99 170.63 12.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.354 0.597 . . . . 0.0 111.821 -176.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -114.87 106.3 14.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.552 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.648 HD13 HD21 ' A' ' 54' ' ' LEU . 3.6 mp -103.77 110.4 63.86 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.9 Cg_exo -69.63 153.25 69.78 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.842 2.361 . . . . 0.0 112.558 -175.218 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -70.54 126.99 92.39 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.501 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.94 112.32 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.954 2.436 . . . . 0.0 113.218 -175.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -77.52 -21.34 11.6 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.62 2.213 . . . . 0.0 111.33 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -97.66 143.25 28.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.074 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.8 mm-40 -72.17 -27.62 62.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.758 0.313 . . . . 0.0 110.862 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.57 -52.03 65.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.284 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.417 ' O ' ' HB2' ' A' ' 91' ' ' PHE . 53.3 t -67.49 -37.15 78.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.627 177.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.472 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 4.8 t80 -53.72 -50.87 64.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.355 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.29 -27.12 47.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.093 -174.737 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.2 t -87.19 -43.01 15.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.896 -0.321 . . . . 0.0 111.507 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 48' ' ' LEU . 2.5 m-85 -77.8 -0.87 28.78 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -174.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 88' ' ' TYR . 8.5 mttt -57.29 -30.35 64.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.214 0.53 . . . . 0.0 110.478 176.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.528 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 62.7 t30 -158.3 76.08 0.75 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.465 172.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -107.68 95.35 14.06 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.342 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.528 ' HD3' ' O ' ' A' ' 93' ' ' ASN . 8.0 Cg_exo -73.6 104.5 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.651 2.234 . . . . 0.0 110.448 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.8 130.47 46.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.783 -173.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.896 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 32.9 t70 -75.13 102.1 4.81 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -70.38 116.98 11.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.37 0.605 . . . . 0.0 110.48 -175.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 4.7 tttt -131.62 128.05 21.67 Favored Pre-proline 0 C--N 1.312 -1.046 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.655 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.648 ' HG3' ' H ' ' A' ' 38' ' ' ALA . 3.2 Cg_exo -33.23 118.72 0.1 OUTLIER 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.861 3.707 . . . . 0.0 111.837 177.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.87 145.68 52.03 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.457 -166.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 . . . . . 0 C--O 1.243 0.761 0 CA-C-N 114.76 -1.109 . . . . 0.0 108.672 175.838 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -59.89 110.16 1.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.653 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 68.74 -75.79 0.06 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.698 0.799 . . . . 0.0 112.099 178.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.25 -126.88 8.81 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 -172.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -118.11 75.45 1.01 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.757 0.313 . . . . 0.0 110.322 174.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 8' ' ' ASN . 1.1 m 61.92 112.69 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.582 178.551 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.55 16.98 8.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.339 0.59 . . . . 0.0 110.32 176.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.419 ' H ' HG22 ' A' ' 6' ' ' THR . 3.2 t30 -113.32 134.9 54.38 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.857 177.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.4 t30 63.75 44.56 4.93 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.333 0.587 . . . . 0.0 110.103 -176.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.8 -163.45 14.34 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.502 -175.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -171.92 -114.01 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 87.68 5.29 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 172.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.26 51.4 2.49 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.927 -0.579 . . . . 0.0 113.388 -172.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' A' ' 18' ' ' ASN . . . -65.72 -25.37 67.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.045 0.45 . . . . 0.0 109.942 175.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -57.7 3.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.399 176.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.476 HG12 HG23 ' A' ' 87' ' ' VAL . 52.8 mt -57.88 -46.66 87.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.45 -178.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.69 -39.97 86.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.987 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.5 t30 -71.96 -41.47 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.037 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.9 -40.02 96.28 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.423 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -62.76 -37.33 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.783 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.24 -39.58 43.69 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.386 178.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -62.68 -26.46 68.67 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.285 0.234 . . . . 0.0 111.429 -178.291 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 20' ' ' ALA . 65.2 mt -62.91 -39.22 84.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.233 0.539 . . . . 0.0 110.03 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' CE1' ' A' ' 101' ' ' HIS . 29.7 mttt -74.07 -28.99 61.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.179 178.092 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -67.7 -39.33 84.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.725 0.298 . . . . 0.0 110.691 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.76 -31.78 68.67 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.476 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.618 HG23 ' HB3' ' A' ' 73' ' ' ALA . 43.2 mt -66.18 -31.65 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.665 -176.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.692 ' HA ' ' OG ' ' A' ' 35' ' ' SER . 0.8 OUTLIER -71.69 -33.1 68.53 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.108 -0.37 . . . . 0.0 111.108 179.495 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.24 4.8 1.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.761 178.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 1.6 mmmt -119.36 -0.54 10.92 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.593 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 0.2 OUTLIER -123.4 -30.51 3.66 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.384 -176.988 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.429 ' C ' ' H ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER 66.77 75.84 0.31 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 122.819 0.448 . . . . 0.0 110.945 179.204 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' ' 36' ' ' SER . 0.0 OUTLIER 60.25 5.01 0.74 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 122.181 0.991 . . . . 0.0 112.224 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.593 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -78.35 -30.96 48.36 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.492 173.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.692 ' OG ' ' HA ' ' A' ' 28' ' ' GLU . 0.7 OUTLIER -68.76 -17.87 64.11 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.823 176.072 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' A' ' 33' ' ' ASP . 39.4 m -76.39 69.74 2.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.998 175.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -88.36 -157.27 0.41 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.952 -175.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.633 ' O ' ' HG3' ' A' ' 100' ' ' PRO . . . -75.32 165.63 24.86 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.011 174.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -70.4 61.03 0.85 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.382 -0.437 . . . . 0.0 113.141 178.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.434 ' HB2' HD22 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -94.8 166.24 12.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 178.953 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.1 m -118.13 121.2 39.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.911 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.452 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 6.0 t -115.91 151.09 36.0 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -137.56 102.2 4.7 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 0.0 110.387 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.14 136.12 41.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.409 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.794 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 ptm180 -85.21 124.91 32.4 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.06 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -127.7 111.09 23.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 121.167 0.508 . . . . 0.0 111.168 -173.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 92' ' ' LYS . 29.1 ttmt -108.0 104.22 13.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.373 -0.83 . . . . 0.0 108.891 176.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 tp -96.37 142.55 28.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.145 0.498 . . . . 0.0 111.898 -173.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.617 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.19 166.13 13.24 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.824 176.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.617 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 25.8 Cg_endo -61.81 -10.15 16.28 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.756 2.304 . . . . 0.0 112.703 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.35 -6.61 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.477 177.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 81' ' ' LYS . . . 78.36 16.92 78.8 Favored Glycine 0 CA--C 1.51 -0.25 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.89 -177.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -104.84 146.25 29.26 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -90.12 101.74 14.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -28.06 60.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.094 0.473 . . . . 0.0 110.07 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.593 ' HB3' ' HB3' ' A' ' 47' ' ' LYS . 28.7 t70 -128.93 104.15 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.538 175.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -133.76 111.74 15.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.34 148.09 15.19 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.408 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.617 ' HD3' HD11 ' A' ' 71' ' ' LEU . 39.3 Cg_endo -70.34 112.91 3.3 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 121.964 1.776 . . . . 0.0 111.656 177.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -73.45 -34.85 65.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.411 0.624 . . . . 0.0 109.589 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 176.88 -177.23 48.2 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.401 177.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.25 -150.84 17.43 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.013 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.3 112.55 42.3 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.784 0.326 . . . . 0.0 110.303 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.46 -40.26 82.54 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.339 2.693 . . . . 0.0 113.399 -174.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.0 -46.71 86.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.951 0.405 . . . . 0.0 111.188 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.434 HD22 ' HB2' ' A' ' 40' ' ' LYS . 16.3 tp -65.61 -38.9 90.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.553 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.551 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 24.9 m -67.93 -44.72 76.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.265 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.718 ' HA ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -62.17 -38.77 90.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.702 0.286 . . . . 0.0 110.822 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.478 ' HB1' ' CE2' ' A' ' 31' ' ' PHE . . . -60.73 -44.76 96.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.642 178.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.3 82.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.075 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 68' ' ' GLN . 51.7 mt -53.52 -46.64 70.18 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.708 -177.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.13 -37.24 46.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.618 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -75.64 -39.6 57.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.112 -175.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -32.01 73.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -176.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -67.91 -30.56 69.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.0 110.966 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 57.3 mt -98.23 -2.59 39.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.541 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -78.02 149.07 34.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.442 -179.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.95 66.45 6.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -178.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 53.4 mt -78.51 116.71 61.53 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.878 176.054 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 23.4 Cg_exo -67.29 151.53 80.66 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 123.011 2.474 . . . . 0.0 112.761 -175.537 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.508 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -73.86 138.62 76.52 Favored Pre-proline 0 N--CA 1.443 -0.821 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.453 175.364 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.04 106.92 0.22 Allowed 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.114 2.543 . . . . 0.0 112.835 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -77.16 -25.1 8.96 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.601 2.201 . . . . 0.0 111.832 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.42 135.26 54.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.695 177.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -66.51 -27.83 68.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.956 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.4 -37.26 86.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.141 0.496 . . . . 0.0 110.75 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.476 HG23 HG12 ' A' ' 16' ' ' ILE . 0.8 OUTLIER -71.99 -33.92 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.292 177.57 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -69.66 -31.63 69.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.514 176.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.898 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -65.9 -35.38 80.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.396 179.295 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t -79.69 -45.89 22.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.566 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.29 5.32 8.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.178 -176.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.898 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 6.1 ttmt -63.7 -23.69 67.47 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.229 0.538 . . . . 0.0 110.117 176.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -170.07 75.15 0.08 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.292 175.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.453 ' HB2' ' O ' ' A' ' 90' ' ' VAL . . . -122.09 85.2 46.02 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.452 -173.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.794 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 12.6 Cg_exo -73.05 104.51 1.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.747 2.298 . . . . 0.0 110.725 178.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 41.6 mt -95.24 158.84 15.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.823 -172.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -80.07 146.67 31.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.258 177.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.452 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 64.7 t80 -129.55 130.84 46.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.029 0.443 . . . . 0.0 110.507 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 165.6 34.23 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.633 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 28.4 Cg_endo -60.45 90.44 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.406 2.07 . . . . 0.0 113.202 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.482 ' CE1' ' HB2' ' A' ' 24' ' ' LYS . 1.5 t60 -53.04 128.18 26.56 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.42 -178.547 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 . . . . . 0 C--O 1.246 0.887 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.336 177.018 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.5 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.981 0.42 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -62.91 -26.88 69.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.91 178.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.256 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.07 -31.11 69.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.469 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.31 64.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.288 0.566 . . . . 0.0 109.879 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.21 -32.28 72.39 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.833 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.449 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -60.06 -30.16 69.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.98 0.39 . . . . 0.0 110.894 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.552 ' O ' HG13 ' A' ' 27' ' ' ILE . 2.6 mt -76.36 -35.12 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.024 0.44 . . . . 0.0 109.954 176.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -62.28 -46.53 88.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.002 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.0 -34.46 75.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.232 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.39 -32.45 72.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.391 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 23' ' ' ILE . 8.5 mt -67.97 -32.81 57.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.707 -176.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -40.08 93.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.639 0.257 . . . . 0.0 111.208 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.41 14.13 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -119.26 -8.55 10.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 176.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.723 176.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.467 ' HB2' HD22 ' A' ' 66' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.461 0.081 0 CA-C-O 120.895 0.379 . . . . 0.0 110.876 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -141.14 139.66 33.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.785 176.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.623 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 52.8 t -138.05 79.6 1.75 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.47 0.652 . . . . 0.0 110.823 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -70.14 120.99 16.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.012 176.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.585 HD23 ' HA ' ' A' ' 59' ' ' PRO . 67.0 mt -113.64 124.56 52.62 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.91 0.386 . . . . 0.0 110.666 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -81.02 88.17 5.96 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.3 pt -113.89 152.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.447 -174.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 56' ' ' ASP . 5.0 mtmt -140.33 112.62 7.81 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.375 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 2.3 tp -95.55 118.65 32.65 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 120.915 0.388 . . . . 0.0 110.952 -177.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.621 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -67.57 159.05 80.47 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.979 176.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.471 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 37.4 Cg_exo -57.04 -15.91 19.15 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.864 2.376 . . . . 0.0 112.777 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.83 -0.93 57.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.327 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.52 52.94 4.89 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.52 -0.848 . . . . 0.0 112.426 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.71 140.61 23.78 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.16 107.54 17.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.006 0.431 . . . . 0.0 110.657 -178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.621 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -76.6 -37.37 56.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.902 177.54 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.616 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -112.7 140.15 47.72 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.885 178.723 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -158.82 106.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.364 0.602 . . . . 0.0 110.128 177.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.402 ' HG3' ' HD2' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -140.43 127.05 12.02 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.191 -175.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.585 ' HA ' HD23 ' A' ' 44' ' ' LEU . 64.1 Cg_endo -76.62 111.08 3.18 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.701 2.267 . . . . 0.0 112.422 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -124.17 21.46 8.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.736 0.779 . . . . 0.0 109.957 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.45 ' HA2' ' HB ' ' A' ' 43' ' ' THR . . . -79.81 -151.84 7.04 Favored Glycine 0 C--N 1.32 -0.345 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.368 -177.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -115.85 -13.02 8.87 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.822 -0.704 . . . . 0.0 113.2 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -117.63 112.46 38.93 Favored Pre-proline 0 C--N 1.327 -0.403 0 O-C-N 122.551 -0.381 . . . . 0.0 110.466 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.445 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 36.7 Cg_endo -68.96 -27.38 30.43 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.691 2.261 . . . . 0.0 112.886 -176.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -77.71 -51.74 10.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.735 0.302 . . . . 0.0 110.85 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.467 HD22 ' HB2' ' A' ' 40' ' ' LYS . 12.8 tp -56.87 -44.05 81.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.387 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.2 m -69.76 -38.89 76.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.914 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.445 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 1.3 mp0 -62.18 -40.83 97.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.011 0.434 . . . . 0.0 110.888 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.72 55.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.032 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.62 -37.94 76.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.812 -178.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 22.0 mt -55.3 -44.03 75.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.771 0.32 . . . . 0.0 111.198 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.41 46.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.267 -178.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.83 91.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.554 -177.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.33 79.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 111.196 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.007 0.432 . . . . 0.0 110.967 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 mt -92.27 -3.6 55.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.694 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -80.08 168.3 19.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -100.56 106.63 18.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 110.906 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mp -119.35 116.89 33.44 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.104 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -78.96 172.44 14.95 Favored 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 122.733 2.289 . . . . 0.0 113.066 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 124.33 89.78 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.195 178.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.488 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 68.7 Cg_exo -53.61 114.99 2.02 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.236 2.624 . . . . 0.0 112.646 -178.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 7.2 Cg_endo -92.14 -75.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.351 2.701 . . . . 0.0 112.903 -174.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.35 134.63 56.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.804 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.77 -36.48 74.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.49 -176.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.01 -47.36 83.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.829 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 83.7 t -66.72 -43.62 89.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.441 178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.471 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 6.1 t80 -60.87 -41.58 96.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.116 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.452 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 16.4 mm-40 -62.92 -24.77 68.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 0.0 111.234 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.406 HG12 ' HB2' ' A' ' 94' ' ' ALA . 93.3 t -92.43 -45.01 14.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.624 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.406 ' HD1' ' HA ' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -59.95 -30.47 69.1 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -175.228 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 48' ' ' LEU . 3.1 ptpt -66.27 -8.22 23.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.731 0.3 . . . . 0.0 111.602 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -164.38 59.94 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.914 0.387 . . . . 0.0 110.114 176.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.406 ' HB2' HG12 ' A' ' 90' ' ' VAL . . . -115.75 89.2 22.72 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.171 -178.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.546 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 2.3 Cg_endo -76.1 103.14 1.69 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.07 1.847 . . . . 0.0 110.399 175.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.0 mt -102.75 153.24 20.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.973 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.573 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -94.38 132.35 39.1 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.023 175.121 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.623 ' O ' ' HB3' ' A' ' 42' ' ' CYS . 82.4 m-85 -113.98 98.92 7.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.473 0.654 . . . . 0.0 110.075 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.681 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -112.23 173.99 2.57 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.608 177.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.681 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 35.5 Cg_exo . . . . . 0 C--N 1.356 0.952 0 C-N-CA 123.092 2.528 . . . . 0.0 112.855 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.134 0 CA-C-O 120.675 0.274 . . . . 0.0 111.121 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.32 -29.84 71.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.623 -177.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -62.37 -46.22 89.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.875 0.369 . . . . 0.0 110.741 178.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.68 -28.91 51.2 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.831 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.63 -35.99 82.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 110.33 175.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.1 -33.88 84.71 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.796 177.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -45.72 92.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.2 mt -64.82 -45.68 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.798 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -60.33 -35.92 76.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.016 0.436 . . . . 0.0 110.948 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -72.81 -40.55 65.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.501 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.5 -38.48 77.74 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.739 0.78 . . . . 0.0 110.631 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.544 HG23 ' HB3' ' A' ' 73' ' ' ALA . 8.5 mt -66.04 -43.44 92.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.262 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.12 -22.12 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -178.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -26.21 60.78 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.839 177.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.446 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.32 -51.9 7.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.891 174.757 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-O 121.057 0.456 . . . . 0.0 110.006 177.095 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.426 ' HB2' HD22 ' A' ' 66' ' ' LEU . 8.9 mmtp . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.827 0.346 . . . . 0.0 111.234 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.18 156.78 44.73 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.287 176.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.71 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 8.2 t -142.52 151.39 41.58 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.0 m -125.16 103.23 7.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.218 0.532 . . . . 0.0 110.907 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.8 mt -92.59 113.18 25.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.009 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.725 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.3 mmt-85 -81.73 88.17 6.29 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.2 pt -101.04 151.74 5.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.074 -174.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HE2' ' HB3' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -134.7 89.17 2.51 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.92 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.6 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 1.6 tp -80.74 123.2 28.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.393 -172.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.434 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -74.31 152.29 87.95 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 173.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -57.37 -16.4 22.76 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.053 2.502 . . . . 0.0 112.58 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.88 -14.34 62.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.723 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.05 59.94 2.23 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.807 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.97 146.11 20.21 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.36 82.1 2.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.321 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.477 ' HG ' ' H ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -73.9 -19.57 60.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 177.801 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.482 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -125.05 117.26 23.57 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.488 177.391 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.5 tt -159.46 111.03 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.499 . . . . 0.0 110.531 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.5 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -137.74 135.05 18.58 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.183 -177.238 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.747 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 2.0 Cg_endo -80.64 74.36 5.58 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.414 2.743 . . . . 0.0 111.308 177.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.611 ' HB2' ' HG3' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -65.37 -34.15 77.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.081 -175.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -144.16 163.38 27.77 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.099 177.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.708 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 109.84 179.77 20.83 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.181 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.11 123.41 87.22 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-O 120.352 0.12 . . . . 0.0 110.797 -179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -53.41 -46.05 36.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.327 2.685 . . . . 0.0 113.234 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.1 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.822 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 100' ' ' PRO . 14.0 tp -59.82 -43.9 94.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.845 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.747 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 92.7 m -64.62 -37.74 88.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.828 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 71' ' ' LEU . 2.4 tt0 -63.07 -40.77 98.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.868 0.366 . . . . 0.0 110.896 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.31 -45.61 92.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.429 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.46 -31.27 70.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.424 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 23.1 mt -55.7 -52.26 64.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.124 0.488 . . . . 0.0 111.328 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -76.86 -36.69 56.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.986 -177.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.544 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -64.05 -46.65 83.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.734 -178.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.33 90.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.708 0.29 . . . . 0.0 111.58 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -71.31 -26.95 63.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.446 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.6 OUTLIER -92.95 -2.42 55.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.739 178.401 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.501 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -90.9 156.99 17.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.282 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -97.5 101.2 12.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.071 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -88.54 115.59 63.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.795 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.31 130.76 35.36 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.537 2.158 . . . . 0.0 112.024 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -59.92 121.16 56.34 Favored Pre-proline 0 N--CA 1.445 -0.713 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.891 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.429 ' CB ' ' HB2' ' A' ' 88' ' ' TYR . 47.0 Cg_exo -39.17 104.62 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 124.307 3.338 . . . . 0.0 114.492 -173.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -83.58 -52.2 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.895 2.397 . . . . 0.0 111.843 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.66 126.46 31.04 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -66.47 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.167 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.34 -43.22 86.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 174.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.618 HG13 ' HD2' ' A' ' 91' ' ' PHE . 1.8 t -62.48 -42.54 96.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.606 175.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.429 ' HB2' ' CB ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -60.87 -44.51 96.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.001 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.869 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -70.78 -21.24 62.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -175.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.4 t -92.53 -55.0 6.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.699 0.285 . . . . 0.0 111.245 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.618 ' HD2' HG13 ' A' ' 87' ' ' VAL . 12.9 m-85 -67.48 -14.95 63.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -173.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.869 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 3.4 pttp -70.31 -6.01 32.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.018 0.437 . . . . 0.0 110.679 177.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -164.93 67.69 0.14 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.103 173.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -136.24 97.85 11.76 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.866 -176.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.725 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 13.2 Cg_exo -72.02 112.6 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.466 2.111 . . . . 0.0 110.262 178.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.455 HD11 ' HE1' ' A' ' 91' ' ' PHE . 11.8 mt -88.54 149.15 23.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.993 -168.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.61 126.51 34.55 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.585 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.71 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 19.4 t80 -98.54 102.8 14.65 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.1 0.476 . . . . 0.0 109.824 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -109.86 100.09 41.45 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 174.861 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.465 ' HG3' HD21 ' A' ' 66' ' ' LEU . 2.6 Cg_endo . . . . . 0 N--CA 1.461 -0.385 0 C-N-CA 123.334 2.689 . . . . 0.0 113.191 -170.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 95.8 mt . . . . . 0 CA--C 1.531 0.221 0 CA-C-O 120.726 0.298 . . . . 0.0 111.416 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -65.8 -41.73 91.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.167 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -62.5 -46.06 90.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.467 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.432 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -62.06 -48.11 81.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.772 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -63.66 -29.94 71.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.105 0.478 . . . . 0.0 110.862 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.35 -51.84 20.03 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.524 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 3.6 pt20 -66.12 -26.59 67.52 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.719 HG12 HD12 ' A' ' 79' ' ' ILE . 52.5 mt -64.08 -40.54 89.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 20' ' ' ALA . 3.6 mttp -63.93 -42.07 97.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.298 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 m -62.95 -47.18 84.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.942 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.78 -44.59 77.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.282 0.563 . . . . 0.0 110.545 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.2 mt -61.88 -42.0 92.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.378 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.494 ' C ' ' H ' ' A' ' 30' ' ' LYS . 4.0 tm-20 -76.39 -27.7 56.46 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.254 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.3 m -76.9 24.48 0.16 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.561 0.696 . . . . 0.0 110.72 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -133.34 -33.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.739 177.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.452 ' HE2' ' HB1' ' A' ' 69' ' ' ALA . 1.0 OUTLIER . . . . . 0 CA--C 1.534 0.362 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.59 -176.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.133 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.37 134.73 31.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.14 92.32 3.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.099 0.476 . . . . 0.0 110.684 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.487 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -67.04 118.23 10.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.0 mt -108.42 118.46 36.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.755 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.3 mtt180 -82.26 89.57 6.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.784 177.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.31 148.13 6.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.795 -173.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.562 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 11.1 mttt -130.18 103.71 6.89 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.988 176.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.24 145.84 25.14 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.086 0.47 . . . . 0.0 111.701 -174.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -96.54 160.9 28.46 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.864 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 27.4 Cg_endo -63.88 0.81 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.035 2.49 . . . . 0.0 113.319 -178.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -104.12 -2.39 25.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.014 0.435 . . . . 0.0 110.555 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.491 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 97.31 -23.66 34.83 Favored Glycine 0 C--O 1.226 -0.354 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.585 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.9 ptm -73.31 148.98 43.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.746 0.308 . . . . 0.0 110.446 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -85.8 124.79 32.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.808 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.88 -14.7 33.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.167 0.508 . . . . 0.0 109.947 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.562 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 42.4 t0 -160.44 140.08 11.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.919 178.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 5.7 tt -159.25 113.32 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 120.971 0.415 . . . . 0.0 110.321 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HB3' ' HE3' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -141.46 142.08 25.18 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.725 -178.488 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.531 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 14.7 Cg_exo -69.72 128.98 16.84 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.477 ' HB3' ' HB ' ' A' ' 43' ' ' THR . 22.8 tt0 -83.19 -57.91 3.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.575 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -156.07 144.46 10.9 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.58 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 158.53 -133.42 3.43 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.384 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -113.52 125.32 29.76 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.84 -43.88 52.74 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.98 2.454 . . . . 0.0 112.82 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.81 -52.01 42.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.126 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.4 HD21 ' HD3' ' A' ' 100' ' ' PRO . 23.1 tp -57.43 -47.3 82.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.968 0.413 . . . . 0.0 110.97 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.2 m -63.61 -42.71 98.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.06 -178.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -63.15 -41.01 99.19 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.814 0.34 . . . . 0.0 110.819 179.033 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.452 ' HB1' ' HE2' ' A' ' 31' ' ' PHE . . . -65.7 -42.33 91.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.564 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.53 -37.6 81.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.113 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.759 HD12 ' HA ' ' A' ' 68' ' ' GLN . 24.9 mt -59.82 -50.14 74.96 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.587 178.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.13 97.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.168 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.38 81.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.212 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.75 -27.78 69.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.292 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt -69.32 -34.6 74.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.626 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.492 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -85.95 -28.49 24.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -178.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 126.94 31.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.1 mtpt -94.85 107.27 19.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.876 -177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.719 HD12 HG12 ' A' ' 23' ' ' ILE . 6.9 mm -81.42 128.22 70.71 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.062 177.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 17.9 Cg_exo -64.93 132.35 31.98 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.747 2.298 . . . . 0.0 111.01 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.485 ' HB3' ' HE2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -53.11 128.04 47.54 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.011 -177.094 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 20.4 Cg_endo -64.49 121.32 8.87 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.782 2.321 . . . . 0.0 112.001 -176.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 6.6 Cg_endo -83.91 -69.06 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.926 2.417 . . . . 0.0 112.53 -176.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.22 134.07 55.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.233 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.41 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 2.1 mt-30 -55.12 -40.42 70.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.726 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.46 -50.97 71.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.951 0.405 . . . . 0.0 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.1 -42.02 95.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.973 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -65.26 -36.01 82.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.395 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 19.8 mm-40 -76.48 -40.29 50.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.0 110.549 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.2 t -64.33 -46.03 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.177 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -76.99 -6.19 51.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.667 -177.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 8.2 mttt -61.32 -23.72 65.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.023 0.44 . . . . 0.0 110.258 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.48 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.7 OUTLIER -158.11 74.82 0.73 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.968 174.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -116.86 81.95 12.63 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.084 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.755 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.7 Cg_exo -73.41 104.83 1.87 Allowed 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.751 2.3 . . . . 0.0 111.192 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.6 146.34 23.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.204 -174.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.487 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -79.18 94.15 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.447 ' HZ ' HG22 ' A' ' 23' ' ' ILE . 1.1 m-85 -86.14 103.2 14.57 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.628 0.727 . . . . 0.0 110.894 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -109.92 158.21 35.6 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.46 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.4 ' HD3' HD21 ' A' ' 66' ' ' LEU . 79.0 Cg_exo . . . . . 0 C--N 1.348 0.536 0 C-N-CA 122.685 2.257 . . . . 0.0 111.582 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.504 HD13 HG23 ' A' ' 87' ' ' VAL . 24.6 mm . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.96 0.41 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -44.07 95.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.099 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.435 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 4.5 t-20 -68.45 -32.89 73.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.09 -48.19 45.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.739 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB2' ' HZ ' ' A' ' 91' ' ' PHE . . . -58.2 -49.05 78.41 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.162 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -61.7 -43.02 99.81 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.344 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -60.87 -32.52 71.95 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.655 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.419 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 52.6 mt -67.68 -42.41 86.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.852 0.358 . . . . 0.0 110.362 178.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.81 -40.3 95.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.716 176.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.586 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 12.4 m -64.8 -41.98 95.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.97 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -56.37 -50.42 71.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.5 mt -63.46 -43.85 98.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.5 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.586 ' OE1' ' HA ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -65.61 -26.38 67.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.792 0.33 . . . . 0.0 111.069 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.3 m -76.44 -1.93 29.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.752 0.31 . . . . 0.0 111.093 177.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 6.2 mmtt -115.17 2.14 14.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 0.0 110.636 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.534 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.737 0.303 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.81 HG23 ' HG3' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -122.66 162.14 22.5 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.208 177.633 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.677 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 43.2 t -146.79 142.01 27.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.548 -178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.98 104.27 7.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.517 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.42 125.48 51.03 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.913 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.967 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.4 OUTLIER -74.05 127.81 33.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 173.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.478 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.1 pt -129.26 142.3 44.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.073 0.464 . . . . 0.0 110.217 -178.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HB2' ' CB ' ' A' ' 56' ' ' ASP . 7.7 mtpt -133.02 115.29 14.98 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 48' ' ' LEU . 9.1 mt -79.9 130.2 35.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.129 0.49 . . . . 0.0 111.574 -173.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.34 158.61 43.25 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.9 176.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -59.75 -13.61 22.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.965 2.444 . . . . 0.0 113.361 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -98.79 -6.41 29.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.374 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.452 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 110.88 -19.8 25.08 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.29 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.36 158.66 27.39 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.921 0.36 . . . . 0.0 111.059 -178.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -88.98 106.94 18.75 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 175.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 pp -72.82 -31.88 65.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.304 -178.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.479 ' CB ' ' HB2' ' A' ' 47' ' ' LYS . 0.4 OUTLIER -118.74 124.8 48.17 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.718 176.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.505 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.1 tp -148.56 106.72 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.246 0.546 . . . . 0.0 109.648 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -147.86 128.45 6.89 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.96 -172.787 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.665 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 12.6 Cg_exo -70.26 92.7 0.56 Allowed 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.098 2.532 . . . . 0.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.33 -45.8 75.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.484 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -141.82 -179.12 18.61 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.504 -0.638 . . . . 0.0 111.504 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.677 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 102.32 -178.15 26.45 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.64 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.95 121.92 83.3 Favored Pre-proline 0 C--N 1.327 -0.399 0 C-N-CA 122.415 0.286 . . . . 0.0 110.49 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.82 -43.48 54.15 Favored 'Trans proline' 0 CA--C 1.528 0.216 0 C-N-CA 122.79 2.327 . . . . 0.0 112.74 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.19 -38.95 92.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.853 0.359 . . . . 0.0 111.17 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -71.49 -45.98 61.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.665 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 68.8 m -65.92 -38.99 90.15 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.703 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -64.55 -37.23 86.82 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.819 0.342 . . . . 0.0 110.455 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.07 -37.22 72.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.384 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.99 -27.91 69.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.004 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.5 mt -61.1 -45.31 95.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 110.365 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.25 86.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.621 178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.45 -44.14 92.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.341 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.99 70.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -74.83 -25.98 59.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.339 177.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.0 -13.43 50.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.316 0.579 . . . . 0.0 110.296 177.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -86.28 149.23 25.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.096 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -125.86 91.37 3.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.851 0.357 . . . . 0.0 110.075 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 52' ' ' GLY . 29.2 mm -66.24 127.84 93.49 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.656 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -67.48 153.64 76.0 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.57 2.18 . . . . 0.0 112.263 -175.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.23 122.14 73.7 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.925 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 50.3 Cg_exo -41.34 118.45 0.77 Allowed 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 123.835 3.023 . . . . 0.0 113.879 -174.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 3.1 Cg_endo -79.38 -75.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 123.109 2.539 . . . . 0.0 111.38 177.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.8 124.98 27.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.895 175.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -64.01 -26.97 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.58 0.229 . . . . 0.0 111.021 -177.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.02 -25.9 68.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.204 0.526 . . . . 0.0 110.969 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.504 HG23 HD13 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -77.65 -30.65 16.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.795 178.767 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -78.6 -38.0 41.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.271 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 25.7 pt-20 -67.76 -18.67 64.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.87 0.367 . . . . 0.0 110.877 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -92.07 -49.54 13.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.681 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.565 ' HZ ' ' HB2' ' A' ' 20' ' ' ALA . 22.4 m-85 -87.81 26.24 1.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.1 ttmt -73.08 -31.07 64.13 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.082 0.468 . . . . 0.0 110.27 177.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.447 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 12.5 p-10 -151.87 38.47 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.106 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -102.85 103.63 34.46 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.967 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.9 Cg_exo -72.25 155.11 56.53 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.886 2.391 . . . . 0.0 112.037 -174.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.471 ' HA ' HD22 ' A' ' 96' ' ' LEU . 0.1 OUTLIER -99.19 132.44 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.294 -172.665 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -92.19 120.07 32.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.98 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -117.02 142.49 46.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.382 0.611 . . . . 0.0 111.723 -172.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.81 ' HG3' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -145.18 143.56 20.79 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.532 174.226 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo . . . . . 0 C--N 1.344 0.338 0 C-N-CA 122.665 2.243 . . . . 0.0 111.737 -178.482 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.416 HG23 HG13 ' A' ' 87' ' ' VAL . 1.7 mt . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.134 0.492 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -66.17 -32.02 73.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.681 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -62.17 -43.84 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 177.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.483 ' O ' HG13 ' A' ' 23' ' ' ILE . 11.3 t80 -62.54 -48.36 79.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 177.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.63 -45.64 85.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 111.293 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.36 -35.9 90.87 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.489 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -66.97 -38.96 87.03 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.465 0.172 . . . . 0.0 111.465 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 19' ' ' TYR . 14.1 mt -63.17 -43.14 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.436 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -62.81 -40.19 96.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.722 177.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.2 m -70.26 -34.24 72.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.924 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.637 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -61.09 -40.57 94.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.007 0.432 . . . . 0.0 110.752 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.474 HG23 ' HB3' ' A' ' 73' ' ' ALA . 37.7 mt -66.18 -37.91 80.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.641 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.98 -20.79 60.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.905 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -74.24 -7.94 54.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.215 0.531 . . . . 0.0 110.7 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.644 ' HD2' ' HB2' ' A' ' 76' ' ' LEU . 2.5 mmtm -114.21 -27.16 7.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.034 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.41 174.756 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.774 0.321 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.525 HG23 ' HB2' ' A' ' 99' ' ' LYS . 1.0 OUTLIER -131.87 153.12 50.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.103 176.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 117.32 12.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.879 0.371 . . . . 0.0 110.959 -178.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 m -84.9 104.8 15.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.789 0.328 . . . . 0.0 110.465 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.0 mt -93.49 114.0 26.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.239 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.619 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.6 ttm180 -74.52 96.16 2.89 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.2 pt -117.59 113.78 43.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.382 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.525 ' HG2' HD21 ' A' ' 55' ' ' LEU . 3.2 tttt -97.91 111.72 23.92 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.548 HD13 ' HD2' ' A' ' 91' ' ' PHE . 2.2 mt -94.8 124.86 39.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.0 0.428 . . . . 0.0 110.888 -174.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.61 152.92 95.23 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.011 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.08 -20.17 44.57 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.177 2.584 . . . . 0.0 113.472 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -83.82 -4.03 58.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.699 0.285 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.81 44.45 4.83 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.608 176.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.431 ' O ' ' HG3' ' A' ' 53' ' ' MET . 0.0 OUTLIER -139.39 142.39 37.53 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 177.221 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.83 96.83 7.12 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.777 0.322 . . . . 0.0 110.151 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.525 HD21 ' HG2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -73.01 -35.17 66.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.023 0.44 . . . . 0.0 110.14 -178.71 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.446 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 34.3 t0 -126.62 101.84 6.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.217 177.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 tt -127.99 111.36 24.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.06 0.457 . . . . 0.0 110.294 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -153.79 141.8 13.94 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 -177.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.443 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 20.6 Cg_exo -64.8 124.68 13.52 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.459 2.106 . . . . 0.0 111.865 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.15 -54.57 4.93 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -162.07 144.61 9.87 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 177.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 157.32 -130.03 2.53 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.501 -178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.6 121.59 25.79 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.551 0.215 . . . . 0.0 110.56 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -46.72 -45.0 20.98 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 123.596 2.864 . . . . 0.0 113.431 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.59 -52.11 65.75 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.716 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.455 ' HG ' ' CE2' ' A' ' 98' ' ' PHE . 9.2 tp -66.22 -42.64 88.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 4.0 m -63.51 -42.19 98.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.595 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -65.87 -39.8 91.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.07 91.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.291 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . . . -67.32 -46.31 73.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.723 176.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.411 HD11 ' HD3' ' A' ' 59' ' ' PRO . 1.4 mt -55.06 -46.09 75.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.012 0.434 . . . . 0.0 111.026 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.85 88.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.728 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.474 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -81.98 -41.57 20.58 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -176.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.67 -32.96 72.14 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.63 61.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.169 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.644 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 1.9 mt -90.62 -25.43 20.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 110.566 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.637 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -64.44 138.64 58.52 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.636 -174.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 81.1 2.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.331 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.478 HG12 HG23 ' A' ' 23' ' ' ILE . 2.3 mp -71.44 126.17 91.76 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.552 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.7 Cg_exo -66.8 177.66 3.34 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 123.08 2.52 . . . . 0.0 112.007 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 142.92 31.09 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.271 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.448 ' HA ' ' HD2' ' A' ' 83' ' ' PRO . 6.5 Cg_endo -48.68 118.27 3.28 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.401 2.734 . . . . 0.0 112.223 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' A' ' 82' ' ' PRO . 18.2 Cg_endo -63.57 -29.01 70.12 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.089 2.526 . . . . 0.0 113.313 -175.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.22 159.48 40.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.853 0.358 . . . . 0.0 111.278 -177.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -62.76 -34.75 77.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.12 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.19 -37.9 81.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.416 HG13 HG23 ' A' ' 16' ' ' ILE . 2.2 t -74.63 -26.87 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.866 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.3 OUTLIER -61.59 -37.94 85.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.498 178.23 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -72.44 -35.33 68.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.2 t -70.38 -54.54 18.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.579 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.548 ' HD2' HD13 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -71.01 9.23 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -174.628 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.504 ' HD2' ' O ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -75.04 -25.4 58.68 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.111 -0.368 . . . . 0.0 111.227 177.444 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -173.74 34.64 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.667 0.27 . . . . 0.0 111.628 -177.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -102.54 113.05 66.08 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 120.823 0.344 . . . . 0.0 110.691 176.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.619 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 20.1 Cg_exo -72.83 144.72 39.41 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.052 2.501 . . . . 0.0 111.542 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 96' ' ' LEU . 0.8 OUTLIER -91.69 142.87 27.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -174.869 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.83 97.19 9.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.454 173.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.46 ' CE2' ' HB2' ' A' ' 70' ' ' ALA . 57.6 t80 -79.3 107.4 12.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.454 0.645 . . . . 0.0 110.596 -177.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.596 ' HG2' ' HD2' ' A' ' 100' ' ' PRO . 5.3 ttpt -150.03 148.89 26.09 Favored Pre-proline 0 C--N 1.311 -1.086 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.596 ' HD2' ' HG2' ' A' ' 99' ' ' LYS . 23.8 Cg_exo . . . . . 0 C--N 1.353 0.774 0 C-N-CA 124.202 3.268 . . . . 0.0 112.564 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.0 mt . . . . . 0 N--CA 1.457 -0.078 0 CA-C-O 120.959 0.409 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -60.48 -33.21 72.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.862 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.465 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 17.4 t-20 -74.69 -47.77 29.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.687 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -68.27 -37.73 81.01 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.205 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.94 -27.19 64.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.432 0.634 . . . . 0.0 109.459 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.73 -27.86 73.57 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.052 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 18' ' ' ASN . 50.8 mm-40 -63.4 -33.31 75.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.049 0.452 . . . . 0.0 109.966 176.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.432 HD12 HG23 ' A' ' 79' ' ' ILE . 7.8 mm -77.26 -42.27 30.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.656 176.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.459 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 4.7 mtpm? -58.88 -53.85 53.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.338 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -59.75 -33.08 71.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.657 0.265 . . . . 0.0 111.292 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.3 -50.13 71.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.637 HG23 ' HB1' ' A' ' 73' ' ' ALA . 74.7 mt -68.3 -32.62 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.206 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -20.66 66.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.951 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.44 14.86 28.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 177.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.422 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -148.89 33.3 0.76 Allowed 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.14 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.3 p90 . . . . . 0 N--CA 1.433 -1.307 0 CA-C-N 113.756 -1.566 . . . . 0.0 112.676 -167.993 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.54 ' O ' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.228 -0.078 0 CA-C-O 120.537 0.208 . . . . 0.0 110.572 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.448 ' HA ' ' HB3' ' A' ' 99' ' ' LYS . 23.7 m -153.95 115.83 4.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.56 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.5 OUTLIER -121.16 177.97 4.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.147 -178.571 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.8 m -148.89 122.24 9.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.202 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.491 HD11 ' HB1' ' A' ' 70' ' ' ALA . 18.8 mt -94.23 113.55 25.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.569 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.691 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 tmm_? -78.15 89.44 4.25 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 175.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -102.37 136.67 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.051 -173.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.61 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -114.63 100.15 8.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.319 177.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 tp -86.34 126.41 34.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.202 -174.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.658 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -76.92 167.74 34.12 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.246 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.658 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 6.7 Cg_endo -52.66 -37.96 75.71 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.162 2.575 . . . . 0.0 113.657 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -74.01 -10.7 59.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.948 0.404 . . . . 0.0 111.406 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 97.73 11.58 50.03 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.032 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ptm -98.94 146.71 25.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.472 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -77.48 109.59 11.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.77 0.319 . . . . 0.0 110.306 -179.09 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.61 -21.23 30.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.374 0.607 . . . . 0.0 109.893 178.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.61 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 48.1 t0 -149.3 135.55 19.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.106 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.7 tt -153.89 113.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.221 0.534 . . . . 0.0 110.372 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.6 tttp -151.85 132.61 7.54 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.084 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.53 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 50.8 Cg_exo -55.44 125.41 19.05 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.713 2.275 . . . . 0.0 112.214 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -77.31 -53.53 7.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.965 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -174.39 151.76 13.3 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.038 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.56 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 149.88 -101.67 0.22 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.808 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.576 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 12.6 t70 -141.42 129.44 12.06 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 -178.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -56.33 -40.65 83.3 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.362 2.708 . . . . 0.0 113.432 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.07 -38.3 63.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.928 0.394 . . . . 0.0 110.984 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -66.58 -50.21 63.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.551 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.654 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.3 m -69.45 -21.91 63.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.509 -177.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -67.74 -50.55 56.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.15 -31.47 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.377 177.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.491 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -56.44 -46.19 80.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.45 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 6.4 mt -62.69 -41.31 99.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.893 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.04 -44.89 79.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.018 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.637 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.91 -43.01 94.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.03 -24.56 66.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 0.0 110.952 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 -28.49 46.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.565 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.422 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -86.99 -20.14 27.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.884 -178.074 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -92.59 149.75 21.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.498 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 pttp -105.73 135.41 47.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.422 0.63 . . . . 0.0 111.051 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.432 HG23 HD12 ' A' ' 23' ' ' ILE . 3.5 mp -110.09 130.84 22.4 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.288 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -84.67 164.47 12.2 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.143 1.895 . . . . 0.0 112.21 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 ttmm -70.88 126.87 92.19 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.933 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.488 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 52.4 Cg_exo -54.66 117.73 4.31 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.947 2.432 . . . . 0.0 112.048 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -70.31 -62.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.571 2.181 . . . . 0.0 112.832 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.65 138.81 32.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.748 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.516 ' HA ' ' HB3' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -61.05 -30.79 70.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 0.0 111.046 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.09 -52.76 63.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 177.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -69.12 -35.51 68.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.046 0.45 . . . . 0.0 110.404 178.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.516 ' HB3' ' HA ' ' A' ' 85' ' ' GLN . 0.9 OUTLIER -56.39 -43.87 79.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.873 179.682 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 33.7 mt-10 -75.61 -35.01 60.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.171 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.3 t -64.98 -43.16 96.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.106 0.479 . . . . 0.0 109.885 178.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -83.69 41.83 0.81 Allowed 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.077 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 1.1 tpmp? -101.82 -23.98 14.11 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.121 0.486 . . . . 0.0 109.738 175.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -158.98 59.89 0.42 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.052 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.12 95.78 49.16 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.595 -176.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.691 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.1 Cg_exo -72.96 137.72 27.18 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 123.012 2.474 . . . . 0.0 111.511 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.38 153.66 17.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.77 133.49 40.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.191 173.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.439 ' CZ ' HG21 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -131.82 103.06 6.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.519 0.676 . . . . 0.0 111.25 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.625 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.3 OUTLIER -139.95 167.6 17.78 Favored Pre-proline 0 C--N 1.315 -0.912 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.389 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.625 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 9.5 Cg_endo . . . . . 0 C--N 1.353 0.803 0 C-N-CA 123.059 2.506 . . . . 0.0 110.626 175.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.478 ' HA ' HG23 ' A' ' 87' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.968 0.413 . . . . 0.0 110.835 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -60.5 -26.73 67.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.864 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.32 -52.53 53.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.654 0.264 . . . . 0.0 110.56 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.559 ' CE2' HD11 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -64.03 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.583 178.109 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . -64.28 -39.85 94.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.233 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.52 -33.46 87.31 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.733 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.89 -38.77 86.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.587 0.232 . . . . 0.0 111.214 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.559 HD11 ' CE2' ' A' ' 19' ' ' TYR . 5.8 mt -62.51 -36.03 72.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.003 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 20' ' ' ALA . 3.6 mmtp -58.46 -50.18 74.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.147 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.51 -32.74 58.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.539 -178.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.489 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.89 -47.94 83.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.14 0.495 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.419 HG23 ' CB ' ' A' ' 73' ' ' ALA . 84.1 mt -73.92 -31.39 30.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.804 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -29.38 70.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.912 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.97 -8.54 59.0 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.987 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.49 36.34 4.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.79 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.0 p90 . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 121.482 0.658 . . . . 0.0 110.956 -178.984 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mmtp . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.849 0.357 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.39 162.37 22.9 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.205 175.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.71 107.1 1.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.712 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.2 m -87.59 135.01 33.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.786 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -127.0 126.73 43.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.82 0.343 . . . . 0.0 110.692 -179.033 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.784 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 2.7 ttm-85 -80.61 97.92 7.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.715 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 46' ' ' ILE . 1.6 pt -105.91 149.07 9.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.33 0.586 . . . . 0.0 111.528 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.573 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 22.1 mttp -127.1 109.4 11.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.932 177.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -95.39 150.14 20.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.395 0.617 . . . . 0.0 111.694 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.512 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -111.58 161.06 27.14 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.366 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.493 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.1 Cg_endo -60.05 -17.07 43.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.23 2.62 . . . . 0.0 113.169 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.9 0.43 51.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.791 0.329 . . . . 0.0 111.125 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.62 29.54 52.02 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.869 177.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -132.88 143.98 49.87 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.446 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -89.49 112.48 23.66 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.846 0.355 . . . . 0.0 110.352 -178.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.512 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.0 OUTLIER -74.4 -30.87 62.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.224 -179.532 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.573 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.8 t70 -133.32 139.52 46.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.176 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.428 HG12 HD22 ' A' ' 71' ' ' LEU . 5.6 tt -155.78 106.78 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.293 0.568 . . . . 0.0 109.652 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -124.03 133.75 24.89 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.133 -172.492 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 24.7 Cg_exo -60.47 125.52 17.59 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.461 2.107 . . . . 0.0 111.613 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' ' HB2' ' A' ' 45' ' ' ARG . 9.4 mm-40 -87.66 -68.57 0.75 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.703 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.75 133.74 4.31 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.272 -0.877 . . . . 0.0 111.291 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 154.45 -159.16 28.71 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.176 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 66' ' ' LEU . 12.0 t70 -78.18 125.87 84.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.469 0.176 . . . . 0.0 110.76 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 53.3 Cg_exo -53.6 -37.32 83.09 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.923 2.415 . . . . 0.0 112.82 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.09 -43.58 42.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.213 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.406 ' HB3' ' HB3' ' A' ' 63' ' ' ASP . 37.1 tp -65.99 -47.09 75.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.884 0.373 . . . . 0.0 110.388 179.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.577 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.3 m -62.58 -44.63 95.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.492 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -61.16 -41.51 96.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.907 178.401 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.53 -31.56 72.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.022 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.83 -44.93 68.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 0.1 OUTLIER -62.31 -41.92 98.94 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.836 0.35 . . . . 0.0 110.576 178.696 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -46.57 87.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.957 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.419 ' CB ' HG23 ' A' ' 27' ' ' ILE . . . -65.15 -43.43 91.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.545 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.36 75.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.36 -26.08 55.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.712 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.05 -33.14 33.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.409 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.489 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -81.93 166.95 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.028 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.22 115.39 26.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.1 178.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 28.5 mm -87.31 125.63 65.14 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.959 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.55 124.86 17.28 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.414 2.076 . . . . 0.0 111.715 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.524 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -55.86 145.48 52.57 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.665 -178.386 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.43 ' HG3' ' HZ ' ' A' ' 91' ' ' PHE . 12.4 Cg_exo -34.64 99.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 125.129 3.886 . . . . 0.0 114.774 -175.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -79.07 -37.52 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.529 2.153 . . . . 0.0 111.251 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.503 ' O ' HG12 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -99.42 146.69 26.05 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.012 177.235 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -76.83 -40.08 49.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 111.074 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.9 -27.59 64.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.924 0.393 . . . . 0.0 111.249 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.503 HG12 ' O ' ' A' ' 84' ' ' SER . 0.5 OUTLIER -71.0 -23.7 23.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.618 -178.208 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.519 ' HA ' ' CZ ' ' A' ' 91' ' ' PHE . 89.6 t80 -65.4 -34.03 77.35 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.103 0.477 . . . . 0.0 110.467 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.53 -18.35 60.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.563 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 52.5 t -85.93 -53.4 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.938 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.519 ' CZ ' ' HA ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -81.25 9.87 6.36 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -173.182 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -61.61 -30.18 70.52 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.573 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 10.8 t30 -160.09 72.53 0.5 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.529 -1.214 . . . . 0.0 108.643 171.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.425 ' CB ' ' HA ' ' A' ' 91' ' ' PHE . . . -113.17 84.58 7.38 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.943 -175.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.784 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 21.2 Cg_exo -73.46 110.78 3.14 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.065 2.51 . . . . 0.0 111.71 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.63 151.7 19.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.823 -175.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.712 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 29.2 t70 -103.76 100.94 10.77 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 176.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.53 135.06 33.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.227 0.536 . . . . 0.0 111.251 -176.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.26 144.01 49.17 Favored Pre-proline 0 C--N 1.323 -0.584 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.701 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_exo . . . . . 0 N--CA 1.475 0.419 0 C-N-CA 124.061 3.174 . . . . 0.0 112.061 -179.791 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.402 HG23 ' HA ' ' A' ' 87' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.711 0.291 . . . . 0.0 111.234 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -36.91 85.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.076 0.465 . . . . 0.0 110.554 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -69.91 -37.96 76.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.336 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -42.61 99.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.672 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.42 82.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 0.0 111.111 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.26 -33.79 56.04 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.815 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -28.29 69.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.693 0.283 . . . . 0.0 111.432 -176.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.469 ' O ' HG13 ' A' ' 27' ' ' ILE . 4.0 mt -70.76 -35.5 60.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.71 0.291 . . . . 0.0 110.485 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -59.87 -47.62 85.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.74 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -35.54 75.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.886 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -47.71 81.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.397 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 23' ' ' ILE . 53.6 mt -64.59 -36.72 78.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.943 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -64.2 -38.57 91.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 110.962 176.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.1 m -73.15 -10.42 59.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.164 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.749 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.23 -8.79 15.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.2 -178.608 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.361 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 176.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 120.856 0.36 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -127.3 128.35 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.642 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.21 105.25 6.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.093 0.473 . . . . 0.0 111.473 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -89.27 118.25 28.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.435 -179.362 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.61 127.37 54.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.36 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.82 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 1.1 tpp180 -80.1 111.89 16.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.9 pt -120.97 137.58 54.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.285 0.564 . . . . 0.0 110.771 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -122.93 111.07 16.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.354 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.6 tp -94.95 143.67 26.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.17 0.51 . . . . 0.0 111.701 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.633 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -103.39 166.67 11.37 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.542 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.633 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 36.2 Cg_endo -64.17 -11.51 28.04 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.168 1.912 . . . . 0.0 111.782 177.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 81' ' ' LYS . 24.5 t70 -85.52 -13.38 49.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.309 176.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.03 -15.39 63.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.349 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.53 149.16 36.73 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.975 0.417 . . . . 0.0 110.607 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.26 105.55 17.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.887 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.424 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.2 OUTLIER -68.25 -30.63 69.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.561 . . . . 0.0 109.85 179.204 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -135.24 131.45 36.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.65 176.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -156.49 105.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.172 0.511 . . . . 0.0 109.656 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 7.0 ptpp? -154.77 148.18 18.48 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.906 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.66 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 10.4 Cg_exo -73.0 129.61 14.44 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.032 2.488 . . . . 0.0 111.663 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.36 -70.56 0.72 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.9 127.34 6.96 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.674 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 164.45 -138.8 5.47 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.592 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.535 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 11.5 t70 -122.78 129.97 24.81 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 53.6 Cg_exo -55.76 -34.4 90.85 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.131 2.554 . . . . 0.0 113.68 -176.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.77 -43.3 18.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.751 0.31 . . . . 0.0 110.76 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.681 HD11 ' HD3' ' A' ' 100' ' ' PRO . 0.2 OUTLIER -58.82 -52.25 66.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.569 178.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.66 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 11.9 m -63.06 -36.76 84.65 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.846 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 4.7 tp60 -63.53 -43.24 97.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.72 0.295 . . . . 0.0 110.787 177.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.12 99.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.069 0.461 . . . . 0.0 110.221 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.86 95.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.048 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 66.9 mt -57.56 -49.55 76.02 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.835 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.45 -41.62 94.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.168 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.62 69.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.263 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.03 75.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.842 0.353 . . . . 0.0 111.142 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -68.21 -23.85 64.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.176 0.512 . . . . 0.0 110.891 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.749 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -103.54 3.32 34.59 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.57 179.468 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.45 146.28 45.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.182 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.79 86.25 7.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.87 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.3 109.02 62.73 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.926 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -72.1 159.88 48.83 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.983 2.455 . . . . 0.0 112.762 -174.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 51' ' ' ASP . 2.3 ttmt -69.75 117.55 54.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.499 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 81' ' ' LYS . 32.6 Cg_exo -65.48 109.76 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.764 2.31 . . . . 0.0 112.81 -175.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -82.72 -40.44 0.12 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.468 2.112 . . . . 0.0 111.852 178.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.3 120.37 20.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.309 177.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -65.12 -31.9 73.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.924 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.43 79.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.006 0.432 . . . . 0.0 110.643 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.402 ' HA ' HG23 ' A' ' 16' ' ' ILE . 28.6 t -68.48 -48.98 69.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.544 177.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -37.65 83.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 -179.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.9 mm-40 -71.67 -33.08 68.54 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.622 -178.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.25 -38.0 40.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.193 0.52 . . . . 0.0 110.132 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -79.47 13.7 1.89 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.596 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -70.43 -22.84 62.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.172 175.744 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -161.58 77.84 0.54 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.154 174.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -129.83 80.84 70.6 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.264 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.82 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.4 Cg_exo -73.18 141.24 32.15 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.747 2.298 . . . . 0.0 111.742 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.3 mt -97.96 129.43 44.86 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.291 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.509 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 31.8 t70 -97.85 95.21 7.37 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 172.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -104.32 139.49 39.23 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.492 0.663 . . . . 0.0 112.14 -169.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.38 150.1 48.92 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 114.466 -1.243 . . . . 0.0 107.808 171.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.681 ' HD3' HD11 ' A' ' 66' ' ' LEU . 14.5 Cg_endo . . . . . 0 C--N 1.344 0.294 0 C-N-CA 121.915 1.743 . . . . 0.0 110.817 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.437 ' HA ' HG23 ' A' ' 87' ' ' VAL . 6.9 mt . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.843 0.354 . . . . 0.0 110.972 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.88 -37.49 84.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.664 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -70.23 -47.23 62.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.751 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.465 ' CB ' HG21 ' A' ' 87' ' ' VAL . 5.3 t80 -58.44 -49.04 78.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.992 179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.28 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.259 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.81 -49.1 10.84 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.179 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -56.81 -39.28 73.89 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 122.72 0.408 . . . . 0.0 111.658 -177.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.497 HG12 HD12 ' A' ' 79' ' ' ILE . 76.0 mt -57.72 -43.8 84.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.995 0.426 . . . . 0.0 110.61 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.451 ' HA ' ' HZ ' ' A' ' 98' ' ' PHE . 31.8 mttp -65.09 -47.77 76.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.927 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.47 -39.35 79.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.392 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.493 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -66.53 -46.63 75.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.047 0.451 . . . . 0.0 110.677 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.45 HD12 ' CE2' ' A' ' 98' ' ' PHE . 1.7 mt -62.96 -50.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.287 -178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -20.82 66.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.037 -176.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 60.1 m -67.45 -11.84 58.84 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.77 0.319 . . . . 0.0 111.049 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HE2' ' HA ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -113.17 9.81 18.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.091 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' A' ' 31' ' ' PHE . 1.9 m-30 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.479 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 120.989 0.423 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.28 168.7 11.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.602 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 4.7 t -152.89 57.64 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.049 0.452 . . . . 0.0 110.522 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.431 HG23 ' HA ' ' A' ' 97' ' ' ASP . 1.8 m -69.36 114.13 7.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.809 0.338 . . . . 0.0 110.219 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.33 124.28 49.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.805 -176.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.576 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -77.63 97.32 5.06 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 174.567 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 95' ' ' PRO . 1.1 pt -121.41 145.54 27.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -174.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HD3' HD11 ' A' ' 55' ' ' LEU . 2.5 tttp -127.94 115.34 18.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.384 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.489 HD13 ' HD2' ' A' ' 91' ' ' PHE . 15.9 mt -94.54 125.02 38.92 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.741 -175.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.468 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -75.26 148.1 83.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.392 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.715 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 2.4 Cg_endo -48.87 -28.4 13.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.899 3.066 . . . . 0.0 113.621 -176.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.46 7.49 9.71 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.32 46.65 9.86 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.378 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.468 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.51 139.12 26.57 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.165 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.63 122.57 24.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.857 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.506 HD11 ' HD3' ' A' ' 47' ' ' LYS . 1.2 pp -93.81 -31.16 14.48 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -129.48 138.44 51.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.634 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.2 tt -159.15 106.9 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.232 0.539 . . . . 0.0 110.101 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -145.43 139.98 15.47 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.904 -175.331 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 14.9 Cg_exo -66.23 120.67 7.84 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.604 2.203 . . . . 0.0 111.196 176.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -102.53 -49.52 3.83 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.421 -175.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -145.9 111.2 0.57 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.278 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 160.3 -161.95 32.92 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.117 -1.04 . . . . 0.0 112.587 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 14.8 t70 -78.75 129.85 72.48 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 120.752 0.311 . . . . 0.0 110.689 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 31.2 Cg_exo -62.25 -34.03 79.34 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.071 2.514 . . . . 0.0 112.929 -176.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -79.62 -41.76 26.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.92 0.391 . . . . 0.0 110.627 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.419 ' CB ' ' HB3' ' A' ' 63' ' ' ASP . 31.2 tp -59.21 -52.88 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.687 178.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 60.3 m -73.22 -15.13 61.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.716 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -72.68 -39.07 67.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.179 0.514 . . . . 0.0 109.873 174.283 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.86 62.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.379 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.402 ' HA ' ' HZ ' ' A' ' 31' ' ' PHE . . . -60.84 -38.01 84.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.198 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 3.0 mt -61.92 -41.41 97.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.139 0.495 . . . . 0.0 110.278 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.71 71.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.809 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.97 91.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.47 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.66 -30.45 71.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.869 0.366 . . . . 0.0 111.343 -178.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -32.79 58.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.352 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -31.69 36.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.681 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.493 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -70.74 157.61 37.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.981 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.29 94.14 4.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.605 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.497 HD12 HG12 ' A' ' 23' ' ' ILE . 33.1 mm -76.33 122.09 86.11 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.803 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.7 153.79 76.62 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.681 2.254 . . . . 0.0 111.675 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.619 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 0.9 OUTLIER -74.53 147.0 84.43 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 175.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.619 ' HD2' ' HG2' ' A' ' 81' ' ' LYS . 10.6 Cg_endo -52.96 117.03 3.32 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.928 2.419 . . . . 0.0 111.955 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.465 ' HD2' HG11 ' A' ' 87' ' ' VAL . 5.8 Cg_endo -78.67 -64.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.236 1.958 . . . . 0.0 112.404 -177.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 48.2 m -95.49 159.94 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.153 0.501 . . . . 0.0 111.133 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.9 -27.91 68.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.667 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.35 -50.78 71.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.575 -177.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.465 HG11 ' HD2' ' A' ' 83' ' ' PRO . 4.1 p -74.76 -22.66 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.288 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -62.04 -35.95 80.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.289 0.566 . . . . 0.0 110.657 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.648 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.65 -18.0 55.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.138 -178.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.06 -53.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.927 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.715 ' HZ ' ' HA ' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -61.82 -19.03 62.11 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -171.184 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.648 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 8.8 ptpt -73.22 -6.54 46.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.59 -178.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -162.19 50.92 0.2 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.967 0.413 . . . . 0.0 111.15 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -132.84 105.49 12.74 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.228 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.576 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 3.0 Cg_exo -73.77 139.9 28.41 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.707 2.271 . . . . 0.0 110.923 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.56 127.53 35.89 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.066 0.46 . . . . 0.0 111.366 -175.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.431 ' HA ' HG23 ' A' ' 43' ' ' THR . 46.6 t0 -93.07 94.35 8.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 173.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.552 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 0.3 OUTLIER -88.18 137.75 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.652 -171.658 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -137.73 112.51 9.06 Favored Pre-proline 0 C--N 1.319 -0.752 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.8 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo . . . . . 0 C--O 1.235 0.333 0 C-N-CA 123.608 2.872 . . . . 0.0 113.752 -173.181 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.564 HG12 HG22 ' A' ' 87' ' ' VAL . 22.9 mt . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 120.908 0.385 . . . . 0.0 110.688 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -59.41 -45.08 92.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.778 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -67.38 -48.57 67.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.938 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.545 ' HD2' ' HG2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -60.52 -34.78 74.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.624 -176.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.5 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.99 -40.54 96.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.961 0.41 . . . . 0.0 110.995 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.34 -29.22 62.43 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.891 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -62.67 -37.22 85.55 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 122.148 0.179 . . . . 0.0 111.008 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.5 HD12 ' HA ' ' A' ' 20' ' ' ALA . 12.8 mt -58.39 -44.8 89.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.022 0.439 . . . . 0.0 110.717 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -64.3 -45.42 88.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.084 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -72.45 -31.12 65.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.428 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.39 -45.95 83.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.038 0.447 . . . . 0.0 111.081 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.498 HG23 ' HB1' ' A' ' 73' ' ' ALA . 57.9 mt -60.84 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.123 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -74.25 -21.29 59.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.563 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.8 m -67.53 -17.23 64.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.055 0.455 . . . . 0.0 109.816 175.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.7 -47.97 4.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.496 172.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.512 -179.842 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.29 0 CA-C-O 121.19 0.519 . . . . 0.0 111.684 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.3 152.07 36.47 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.829 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.504 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -163.56 90.33 0.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.156 0.503 . . . . 0.0 110.937 -179.601 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.762 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -70.87 116.88 11.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.409 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.2 mt -99.06 118.13 35.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.712 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.2 ttt180 -80.53 101.14 8.95 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -120.26 137.24 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.36 0.6 . . . . 0.0 111.588 -175.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.631 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -129.8 109.23 10.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.107 -0.952 . . . . 0.0 108.605 174.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.51 144.07 36.65 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.529 0.681 . . . . 0.0 111.627 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -100.48 161.5 23.8 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.577 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.652 ' HG3' ' HB2' ' A' ' 88' ' ' TYR . 36.4 Cg_exo -57.45 -14.19 15.62 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.041 2.494 . . . . 0.0 112.699 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.22 -11.89 59.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.107 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.2 34.64 23.06 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.886 -179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.47 144.44 47.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.787 0.327 . . . . 0.0 110.238 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.489 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -100.09 97.21 8.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.8 178.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -29.8 63.62 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.438 -177.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -129.07 127.09 40.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.319 176.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.64 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.0 OUTLIER -159.08 108.77 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.339 -175.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -158.0 151.38 18.95 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -72.45 119.81 6.35 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.926 2.417 . . . . 0.0 111.963 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.762 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 74.3 mt-10 -82.37 -65.06 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.143 0.496 . . . . 0.0 109.766 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -143.77 123.6 2.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.384 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.504 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 173.84 -178.02 45.89 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.375 -0.917 . . . . 0.0 112.795 -178.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.34 129.63 90.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.37 -47.82 25.3 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.939 2.426 . . . . 0.0 112.649 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.26 -46.88 75.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.192 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.96 -55.31 36.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.122 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.657 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.8 m -63.3 -31.74 72.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.045 -177.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -63.83 -46.34 85.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.77 0.319 . . . . 0.0 110.592 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.19 -34.2 74.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.534 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.3 78.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.227 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 51.8 mt -59.96 -44.43 94.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.101 0.477 . . . . 0.0 110.56 178.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.75 73.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.827 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.11 -45.34 89.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.75 -178.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.14 -35.34 80.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.906 0.384 . . . . 0.0 111.155 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -68.57 -32.84 73.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.545 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.3 mp -80.48 -32.04 37.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.856 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.11 130.37 43.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.659 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -88.38 84.68 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.503 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.423 HG21 ' HE2' ' A' ' 91' ' ' PHE . 3.0 mt -70.84 132.18 87.07 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.602 -179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.545 ' HG2' ' HD2' ' A' ' 19' ' ' TYR . 18.9 Cg_endo -61.83 125.26 16.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.747 2.298 . . . . 0.0 112.083 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.5 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -75.33 132.39 76.19 Favored Pre-proline 0 N--CA 1.443 -0.798 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.417 -178.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 60.7 Cg_exo -52.92 115.71 2.44 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.959 2.44 . . . . 0.0 112.712 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 4.6 Cg_endo -81.14 -69.51 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.95 2.434 . . . . 0.0 111.214 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.67 146.65 49.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.596 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.23 -26.76 68.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.855 0.36 . . . . 0.0 111.446 -175.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.07 -27.44 69.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.108 178.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.564 HG22 HG12 ' A' ' 16' ' ' ILE . 13.6 t -77.26 -32.2 18.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.652 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -61.92 -35.5 78.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.06 0.457 . . . . 0.0 110.225 178.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.517 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -67.74 -27.17 66.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.171 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.3 t -68.24 -57.32 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.442 ' HD1' ' HB3' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -85.5 3.35 40.79 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -176.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.517 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -63.82 -23.94 67.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.915 0.388 . . . . 0.0 110.411 178.469 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -163.62 78.22 0.41 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.749 174.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.442 ' HB3' ' HD1' ' A' ' 91' ' ' PHE . . . -135.47 84.25 34.96 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.144 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.712 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 4.3 Cg_exo -74.4 104.68 1.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.786 2.324 . . . . 0.0 110.629 177.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.82 140.67 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.21 -174.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 4.8 t70 -87.45 112.35 22.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.845 177.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -86.81 111.37 20.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.076 0.465 . . . . 0.0 110.595 -177.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 100' ' ' PRO . 4.6 mtmm -105.02 138.58 19.55 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.555 176.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 99' ' ' LYS . 76.3 Cg_exo . . . . . 0 C--O 1.235 0.339 0 C-N-CA 123.338 2.692 . . . . 0.0 112.951 -177.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.431 ' HA ' ' HD2' ' A' ' 19' ' ' TYR . 7.9 mt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.788 0.327 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -66.07 -32.83 74.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.962 0.41 . . . . 0.0 110.853 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -69.65 -50.22 46.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.681 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.431 ' HD2' ' HA ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -62.87 -34.63 77.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.008 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.55 87.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.062 0.458 . . . . 0.0 110.246 175.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.54 -33.02 75.73 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.234 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -60.69 -36.02 77.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.867 0.365 . . . . 0.0 110.78 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.453 HD12 HG23 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -62.61 -40.72 89.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.41 0.624 . . . . 0.0 109.404 177.837 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 13.1 mttt -66.06 -48.06 72.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.298 178.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 m -54.22 -36.73 63.8 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.798 0.332 . . . . 0.0 111.6 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.85 86.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.011 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -77.18 -42.11 31.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.439 -177.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 59.2 mt-10 -55.33 -38.62 68.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.677 -177.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.64 15.34 14.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.886 -176.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HD3' ' HB3' ' A' ' 76' ' ' LEU . 67.9 mttt -151.4 33.48 0.57 Allowed 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.8 p90 . . . . . 0 N--CA 1.438 -1.057 0 CA-C-N 113.887 -1.506 . . . . 0.0 113.316 -167.64 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.787 ' HB3' HD22 ' A' ' 66' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.531 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.5 139.01 45.15 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.64 ' HB2' HD23 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -145.87 107.99 4.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.985 0.421 . . . . 0.0 111.151 -176.082 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.4 m -74.97 112.91 11.68 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.2 mt -103.69 122.48 45.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.934 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.568 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -78.63 102.95 8.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.888 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.64 HD11 ' HB2' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -101.29 110.33 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.279 -176.933 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.557 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -101.98 98.39 8.61 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.93 177.814 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -100.04 131.24 46.12 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.269 0.557 . . . . 0.0 111.07 -174.419 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.406 ' HB3' ' HG2' ' A' ' 53' ' ' MET . . . -75.85 153.66 85.01 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.691 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.06 -27.01 34.6 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.186 2.591 . . . . 0.0 113.296 -178.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -77.35 -5.07 48.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.244 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.15 42.21 6.75 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.642 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.406 ' HG2' ' HB3' ' A' ' 49' ' ' ALA . 1.0 OUTLIER -127.82 149.39 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 177.753 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.477 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -81.43 105.64 12.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.39 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.454 ' HG ' ' HB3' ' A' ' 47' ' ' LYS . 1.5 pp -88.19 -24.28 23.34 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.504 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 26.0 t0 -154.68 111.09 3.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.977 179.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.418 HD12 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -121.51 106.6 18.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.02 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -133.66 129.12 20.27 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -172.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 12.6 Cg_exo -66.68 127.07 16.44 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.557 2.171 . . . . 0.0 110.919 175.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -90.28 -65.77 0.99 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.251 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.67 145.82 13.98 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.639 -0.791 . . . . 0.0 111.72 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 151.82 -136.16 5.35 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.866 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.51 119.21 59.41 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -53.53 -41.16 75.65 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.988 2.459 . . . . 0.0 113.064 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.67 -48.79 53.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.671 0.272 . . . . 0.0 110.933 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.787 HD22 ' HB3' ' A' ' 40' ' ' LYS . 7.8 tp -59.09 -46.39 88.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.699 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.5 m -61.4 -42.03 98.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.266 -177.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -40.2 94.96 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.723 0.296 . . . . 0.0 110.822 179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.05 -38.75 82.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.577 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.23 -36.53 82.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.023 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 45.3 mt -60.63 -45.1 95.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.696 177.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.1 -43.89 90.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.13 -48.71 77.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.115 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.5 -24.45 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.401 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -67.19 -38.13 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.012 0.434 . . . . 0.0 110.426 178.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -91.69 -17.75 24.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.707 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.27 138.17 58.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.189 -177.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.498 ' HD2' ' HA ' ' A' ' 78' ' ' LYS . 0.4 OUTLIER -82.25 86.36 6.67 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.005 178.638 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.453 HG23 HD12 ' A' ' 23' ' ' ILE . 30.5 mm -82.61 121.02 77.74 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.865 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -82.07 146.78 14.52 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.485 2.124 . . . . 0.0 112.219 -176.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.456 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -61.64 147.91 87.8 Favored Pre-proline 0 N--CA 1.446 -0.655 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.418 178.597 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.93 112.64 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.653 2.902 . . . . 0.0 113.524 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.53 -26.97 13.48 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.701 2.267 . . . . 0.0 112.284 -177.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.8 152.62 38.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.107 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -63.38 -34.98 78.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.862 -176.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.58 67.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.065 0.46 . . . . 0.0 110.77 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 88.1 t -68.37 -32.2 54.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.096 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.415 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -59.77 -42.11 92.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.986 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.42 ' H ' ' HG2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -79.81 -39.1 31.51 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.044 -0.262 . . . . 0.0 111.488 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.2 t -70.22 -46.46 71.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CD2' HD22 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -63.54 -13.95 46.42 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.586 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 18.1 mtmt -69.13 -5.83 24.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.861 0.362 . . . . 0.0 110.695 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -169.2 69.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -127.51 84.37 63.56 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.529 -174.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.568 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 11.5 Cg_exo -74.24 105.8 2.1 Favored 'Trans proline' 0 CA--C 1.53 0.322 0 C-N-CA 123.158 2.572 . . . . 0.0 111.8 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.64 ' HB2' HD11 ' A' ' 46' ' ' ILE . 2.7 mp -89.57 150.67 22.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.997 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.459 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 1.7 t0 -92.59 97.26 10.7 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -68.37 128.16 35.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.197 0.522 . . . . 0.0 111.418 -175.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.84 112.02 18.79 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.345 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--O 1.233 0.227 0 C-N-CA 123.141 2.56 . . . . 0.0 111.89 -178.557 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 49.5 mm . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.543 0.211 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -57.64 -47.1 83.17 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -65.17 -44.81 87.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.715 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -44.43 96.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.701 178.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.53 95.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.806 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.49 -43.87 97.51 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.981 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.493 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -66.79 -38.52 86.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.535 0.207 . . . . 0.0 111.04 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.493 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 63.6 mt -65.32 -48.55 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.866 0.365 . . . . 0.0 110.576 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -63.37 -24.93 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.142 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 m -78.77 -45.43 21.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.439 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.96 -40.81 73.77 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.238 0.542 . . . . 0.0 110.879 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.631 HG23 ' HB3' ' A' ' 73' ' ' ALA . 5.8 mt -61.69 -46.18 97.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.56 -21.13 63.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.522 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -68.59 -11.76 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.873 0.368 . . . . 0.0 110.664 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.46 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 3.1 mptp? -103.41 -47.07 4.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.028 176.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.157 176.898 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.685 ' HB3' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -121.06 107.69 12.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.776 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.604 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.3 OUTLIER -104.95 114.6 28.91 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.978 0.418 . . . . 0.0 111.04 -177.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -86.9 99.12 11.62 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.182 176.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.2 mt -85.39 113.03 21.38 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.868 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -74.65 112.67 11.08 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.572 HG13 ' HA ' ' A' ' 95' ' ' PRO . 1.3 pt -131.88 123.05 50.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.815 -171.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 mtmm -102.68 98.93 8.89 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.898 HD23 ' HD2' ' A' ' 91' ' ' PHE . 4.9 tp -93.62 113.07 25.08 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.045 0.45 . . . . 0.0 110.343 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.64 150.08 87.36 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.226 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.802 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 16.3 Cg_endo -58.28 -6.94 3.3 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 123.206 2.604 . . . . 0.0 113.086 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.91 -4.11 56.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.734 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.4 62.65 2.04 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.54 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.99 139.58 9.95 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.517 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -88.93 104.84 17.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.87 0.367 . . . . 0.0 111.0 -178.065 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.09 -37.94 28.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.155 0.502 . . . . 0.0 109.966 177.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -124.51 121.95 36.26 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.108 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.436 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 4.2 tt -143.35 110.35 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.879 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -140.79 143.39 31.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.356 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.536 ' HG3' HD22 ' A' ' 71' ' ' LEU . 8.8 Cg_exo -70.54 103.73 1.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.246 1.964 . . . . 0.0 111.33 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -70.33 -49.67 47.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.055 0.455 . . . . 0.0 110.025 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -173.71 137.74 4.21 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.843 177.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.604 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 168.61 -102.7 0.19 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.429 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -143.01 128.15 9.97 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -55.48 -37.22 95.14 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.799 2.333 . . . . 0.0 112.907 -177.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.99 -48.95 16.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.685 HD22 ' HB3' ' A' ' 40' ' ' LYS . 34.6 tp -63.33 -45.04 93.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.459 ' O ' HD23 ' A' ' 71' ' ' LEU . 4.1 m -65.39 -43.89 89.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.795 -175.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -57.33 -49.81 74.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.742 0.306 . . . . 0.0 110.739 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.66 -29.17 70.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.662 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.16 -51.58 8.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.532 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.536 HD22 ' HG3' ' A' ' 59' ' ' PRO . 0.9 OUTLIER -65.31 -39.22 92.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.318 -176.135 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.566 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . . . -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.1 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.631 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -74.06 -33.45 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.427 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.0 -28.89 68.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 72' ' ' ALA . 8.9 mttm -71.75 -22.78 61.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.071 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -100.95 -19.97 15.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.174 -177.548 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.41 132.94 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.562 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 91.23 8.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.518 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.457 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 38.7 mm -72.22 121.64 85.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.359 179.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 29.5 Cg_exo -64.11 153.19 77.64 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.823 2.349 . . . . 0.0 112.042 -177.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 135.25 88.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 116.21 3.03 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.124 2.55 . . . . 0.0 113.179 -173.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -79.64 -50.01 0.07 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.655 2.237 . . . . 0.0 112.157 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.85 156.8 23.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.772 0.32 . . . . 0.0 110.863 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.89 -27.48 57.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.932 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.587 ' O ' HG23 ' A' ' 90' ' ' VAL . . . -60.76 -40.77 93.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.69 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.2 t -61.9 -42.55 95.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 177.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.548 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 0.7 OUTLIER -58.79 -32.26 69.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.524 178.472 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.514 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 2.7 mm-40 -75.91 -30.23 58.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.885 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.616 HG12 ' HB3' ' A' ' 94' ' ' ALA . 5.4 t -92.42 -53.42 8.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -173.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.898 ' HD2' HD23 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -61.72 -13.11 20.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -168.707 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.3 ptpt -75.33 -13.63 60.43 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.952 -177.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -169.21 22.16 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.616 ' HB3' HG12 ' A' ' 90' ' ' VAL . . . -121.38 123.64 27.57 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 121.752 -0.592 . . . . 0.0 111.27 177.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.868 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.3 Cg_exo -72.7 156.78 53.06 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.191 2.594 . . . . 0.0 112.204 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.75 132.79 40.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.419 -175.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 112.64 19.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.305 174.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -106.35 122.78 46.95 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.296 0.569 . . . . 0.0 110.843 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.545 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -150.66 163.32 24.38 Favored Pre-proline 0 C--N 1.312 -1.024 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.499 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.545 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 5.9 Cg_exo . . . . . 0 C--N 1.348 0.529 0 C-N-CA 123.647 2.898 . . . . 0.0 112.324 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.562 ' HA ' HG22 ' A' ' 87' ' ' VAL . 13.9 mt . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.922 0.391 . . . . 0.0 110.365 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -34.05 70.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.112 0.482 . . . . 0.0 109.926 177.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -63.81 -39.74 94.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.881 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.43 -40.34 82.24 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.083 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.86 -49.67 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.266 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.78 -31.58 73.21 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.052 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -34.12 70.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.606 0.241 . . . . 0.0 110.676 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 60.0 mt -66.39 -41.44 88.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.13 83.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.821 176.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 m -66.79 -38.14 85.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 0.0 110.569 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.04 -34.95 77.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.214 0.531 . . . . 0.0 110.779 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 5.5 mt -83.32 -56.25 6.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.626 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HA ' ' HB2' ' A' ' 31' ' ' PHE . 43.6 mt-10 -75.48 -22.32 57.32 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.595 -170.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -80.42 8.48 7.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.698 -0.627 . . . . 0.0 110.288 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.98 12.39 11.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 172.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.508 -177.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.2 mmtt . . . . . 0 C--O 1.232 0.182 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.26 138.7 40.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.885 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.44 93.38 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.159 0.504 . . . . 0.0 111.65 -176.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.6 m -76.49 113.78 14.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.216 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.672 HD11 ' HB2' ' A' ' 98' ' ' PHE . 0.0 OUTLIER -113.22 125.62 54.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 177.491 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.927 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 12.4 ttm105 -78.48 98.35 6.03 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.023 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -105.33 155.32 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.256 -176.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.67 103.08 5.11 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.004 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -81.82 138.43 35.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.973 0.415 . . . . 0.0 110.991 -177.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.545 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.82 163.76 17.43 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.638 176.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.545 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 33.3 Cg_endo -62.43 -11.89 25.07 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.348 2.032 . . . . 0.0 112.062 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.41 -4.35 59.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.912 177.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.96 10.55 84.86 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.606 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.46 154.12 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.744 0.307 . . . . 0.0 110.473 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.36 102.07 14.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.093 179.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.478 HD11 ' HB2' ' A' ' 49' ' ' ALA . 0.8 OUTLIER -65.2 -42.78 93.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.143 0.497 . . . . 0.0 110.248 -179.6 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -128.31 144.26 51.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.2 tt -158.1 106.34 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.365 0.602 . . . . 0.0 109.408 177.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -135.15 123.63 15.82 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.032 -174.029 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.592 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 21.6 Cg_exo -65.64 120.7 7.93 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.974 2.449 . . . . 0.0 112.15 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -61.86 1.86 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -166.63 -176.71 37.95 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.029 177.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.5 -89.22 0.43 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 -178.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 64' ' ' PRO . 13.1 t70 -133.91 110.29 12.01 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 120.78 0.324 . . . . 0.0 110.518 176.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 63' ' ' ASP . 11.0 Cg_endo -55.99 -36.08 95.43 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 122.717 2.278 . . . . 0.0 112.787 -177.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.84 -53.09 12.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.307 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.915 0.388 . . . . 0.0 110.9 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.592 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 8.5 m -64.74 -42.59 95.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.606 -178.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -68.82 -33.59 74.09 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.933 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.54 69.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 178.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.07 71.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 15.2 mt -61.16 -37.06 81.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.788 0.327 . . . . 0.0 111.14 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.27 -40.93 77.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.873 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.13 74.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.035 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.56 -26.91 68.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.383 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -78.05 -22.74 48.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mt -99.39 -11.4 21.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.501 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.11 125.69 27.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.278 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.91 99.14 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.812 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -112.89 124.72 31.11 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.616 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.7 168.41 19.5 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.55 2.167 . . . . 0.0 112.651 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 1.5 ttmt -66.92 127.73 93.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 7.0 Cg_endo -50.86 110.84 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.31 2.673 . . . . 0.0 112.577 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.74 -27.86 12.16 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.62 2.214 . . . . 0.0 111.457 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.5 ' HB2' HG23 ' A' ' 87' ' ' VAL . 0.6 OUTLIER -107.54 120.05 41.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.154 177.865 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -60.99 -32.07 71.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.12 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.68 78.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.92 0.391 . . . . 0.0 110.913 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.562 HG22 ' HA ' ' A' ' 16' ' ' ILE . 91.0 t -66.6 -44.62 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -62.41 -43.38 98.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.969 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.831 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 3.3 mm-40 -58.05 -32.52 68.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.31 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.23 -58.2 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.452 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -65.43 -18.94 65.71 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.831 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.73 -13.81 61.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.816 0.341 . . . . 0.0 110.918 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -153.08 46.78 0.69 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 110.695 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.82 101.3 11.7 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.812 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.927 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.6 Cg_exo -72.45 131.75 18.03 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.848 2.365 . . . . 0.0 111.53 -178.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.66 146.03 25.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.251 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -97.07 96.71 8.66 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.967 175.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.672 ' HB2' HD11 ' A' ' 44' ' ' LEU . 48.9 t80 -73.16 108.86 6.29 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.419 -173.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.69 135.73 25.43 Favored Pre-proline 0 C--N 1.315 -0.902 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--N 1.346 0.409 0 C-N-CA 123.913 3.075 . . . . 0.0 113.388 -175.693 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.412 HG23 ' CE2' ' A' ' 91' ' ' PHE . 3.2 mt . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -63.36 -37.89 89.04 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -175.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -33.84 76.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.028 0.442 . . . . 0.0 110.413 178.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -73.67 -48.7 30.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.697 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.81 -34.19 77.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.993 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.14 -35.95 91.19 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.191 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -65.85 -42.56 90.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.845 0.355 . . . . 0.0 110.994 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.551 HD12 ' HA ' ' A' ' 20' ' ' ALA . 44.8 mt -57.93 -44.29 86.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.37 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.2 mttp -55.16 -44.27 75.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.541 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.55 -36.67 44.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.975 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.17 -38.31 79.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.677 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 23' ' ' ILE . 6.3 mt -65.43 -38.32 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.985 -178.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -19.28 62.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.415 177.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -68.99 -23.64 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.149 0.5 . . . . 0.0 110.04 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 14.6 mmmt -96.18 -48.38 5.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.572 174.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.1 m-30 . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.852 176.357 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.521 HG23 ' HG2' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -121.99 145.33 48.23 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.8 106.49 4.26 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.693 -177.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.605 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 20.0 m -78.94 113.33 16.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.661 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -108.63 114.25 27.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.196 -176.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.872 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 21.8 ttm180 -79.42 89.07 5.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.7 pt -95.28 111.88 26.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.569 -172.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -93.94 99.44 11.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.37 177.191 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.712 ' HG ' HD23 ' A' ' 54' ' ' LEU . 4.9 mt -85.33 139.51 31.52 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.126 0.489 . . . . 0.0 111.379 -175.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.446 ' HB2' ' CD2' ' A' ' 55' ' ' LEU . . . -96.0 158.8 33.55 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.279 177.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.7 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 32.4 Cg_exo -56.0 -24.09 46.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.966 2.444 . . . . 0.0 112.564 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.434 ' HB2' ' HG2' ' A' ' 53' ' ' MET . 1.4 m-20 -75.19 -9.08 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.127 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 44.75 6.48 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.774 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.434 ' HG2' ' HB2' ' A' ' 51' ' ' ASP . 1.4 ptt? -150.81 142.46 23.63 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.712 HD23 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -88.54 101.58 14.08 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.352 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.446 ' CD2' ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -71.87 -37.22 70.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.1 t70 -123.73 100.13 6.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -111.57 106.18 20.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -113.94 119.96 39.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.611 -170.347 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.684 ' HG3' HD21 ' A' ' 71' ' ' LEU . 2.7 Cg_exo -71.51 110.9 2.98 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.694 2.263 . . . . 0.0 111.176 175.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.419 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 45.7 mt-10 -73.8 -49.21 26.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.209 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 173.22 172.9 39.17 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.472 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.8 -90.66 0.24 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -143.45 112.34 5.5 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.32 -35.01 95.44 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.953 2.435 . . . . 0.0 112.275 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.81 83.38 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.283 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.0 tp -88.05 -40.4 13.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.626 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.599 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.6 m -60.64 -55.07 37.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.298 -175.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HA ' HD12 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -61.99 -29.72 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.681 0.277 . . . . 0.0 111.455 -176.51 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.95 -44.06 27.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.928 0.394 . . . . 0.0 110.851 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.99 -28.97 69.94 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.464 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.684 HD21 ' HG3' ' A' ' 59' ' ' PRO . 91.2 mt -54.58 -44.84 73.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.652 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.6 -41.19 32.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.4 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -57.68 -50.05 74.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.99 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.19 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.85 0.357 . . . . 0.0 111.49 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.641 ' HG2' HD12 ' A' ' 54' ' ' LEU . 2.8 mtmt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 179.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.417 ' HB3' ' HE2' ' A' ' 30' ' ' LYS . 4.7 mp -94.6 -19.76 20.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.878 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.44 158.4 26.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.673 -175.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.03 73.84 5.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.685 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.433 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.9 mm -76.3 120.07 80.04 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.712 178.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 33.7 Cg_exo -63.58 171.56 6.74 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.594 2.196 . . . . 0.0 112.339 -177.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.445 ' HG3' ' HD2' ' A' ' 82' ' ' PRO . 1.1 tppt? -90.98 135.01 29.14 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 175.162 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.445 ' HD2' ' HG3' ' A' ' 81' ' ' LYS . 78.4 Cg_exo -44.16 111.57 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.396 2.731 . . . . 0.0 112.785 -178.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -62.99 -66.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.721 2.28 . . . . 0.0 112.25 -176.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.33 -179.37 3.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.778 0.323 . . . . 0.0 110.637 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -16.49 61.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.073 -177.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.31 -57.8 9.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.467 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.7 t -60.51 -37.57 75.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.63 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.7 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 29.3 t80 -54.0 -52.83 59.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.636 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.531 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 44.6 mm-40 -77.89 -40.81 38.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 111.534 -177.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.68 -52.56 22.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.981 -173.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.525 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 2.2 m-85 -72.69 -5.21 36.03 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -176.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 7.4 mtmt -65.92 -21.34 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 171.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.87 55.37 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.709 179.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.525 ' HB3' ' HA ' ' A' ' 91' ' ' PHE . . . -123.26 93.53 47.89 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -178.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.872 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.4 Cg_exo -73.73 140.08 28.78 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 123.013 2.475 . . . . 0.0 111.941 -178.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.35 135.08 55.14 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.57 -177.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.605 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 25.5 t0 -84.09 103.32 13.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 175.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.61 108.62 3.92 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.082 -175.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.521 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -119.9 116.82 32.69 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.536 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 C--N 1.35 0.612 0 C-N-CA 124.103 3.202 . . . . 0.0 113.356 -177.33 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt . . . . . 0 N--CA 1.464 0.248 0 CA-C-O 120.899 0.38 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -35.36 78.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.973 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -66.47 -48.36 70.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.73 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.45 80.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.298 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.19 -35.56 77.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.765 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.79 -37.12 88.28 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.571 177.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.06 -37.15 86.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.889 0.376 . . . . 0.0 110.632 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 36.1 mt -73.29 -40.07 56.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.409 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.72 -38.0 71.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.433 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.54 -42.81 28.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.867 0.365 . . . . 0.0 110.704 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.61 -47.31 86.07 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.406 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.446 HG23 ' HB1' ' A' ' 73' ' ' ALA . 4.6 mt -64.39 -39.33 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.311 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -21.18 64.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.459 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.44 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 4.3 m -96.53 17.81 15.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.117 0.484 . . . . 0.0 110.691 177.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 29' ' ' SER . 10.1 mmtt -150.81 32.14 0.62 Allowed 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.4 p90 . . . . . 0 N--CA 1.436 -1.158 0 CA-C-N 113.487 -1.688 . . . . 0.0 113.013 -167.827 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.723 ' HB2' HD23 ' A' ' 66' ' ' LEU . 23.2 mttm . . . . . 0 N--CA 1.452 -0.364 0 CA-C-O 120.733 0.301 . . . . 0.0 110.38 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.17 149.09 39.27 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.42 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 33.4 t -152.37 116.6 4.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.041 0.448 . . . . 0.0 111.816 -178.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.896 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.9 m -76.03 121.43 22.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.42 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.7 mt -105.61 129.48 53.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 0.0 110.252 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HB3' ' HD2' ' A' ' 58' ' ' LYS . 8.6 ttt-85 -86.86 93.3 9.26 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.82 113.68 34.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.304 -173.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -101.01 100.86 11.53 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 175.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 91' ' ' PHE . 35.2 mt -93.15 130.03 38.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.947 -175.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.742 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -76.39 138.72 67.57 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 172.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.65 -17.82 18.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.349 2.699 . . . . 0.0 113.342 -175.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -81.32 -0.41 40.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.328 . . . . 0.0 111.174 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.67 63.88 1.52 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.564 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.742 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 1.8 ptp -159.68 135.61 8.68 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.648 HD21 HD13 ' A' ' 79' ' ' ILE . 0.0 OUTLIER -91.26 87.82 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.155 0.503 . . . . 0.0 110.043 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.477 ' HG ' ' N ' ' A' ' 56' ' ' ASP . 0.4 OUTLIER -76.59 -29.43 56.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.378 -178.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.477 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 29.7 t70 -130.52 92.52 3.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.38 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 tt -124.36 106.71 17.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.609 ' HD2' ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -134.3 142.6 43.6 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.47 -173.14 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.483 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 8.9 Cg_exo -69.82 132.29 22.92 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.055 2.503 . . . . 0.0 111.504 177.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -98.98 -76.58 0.53 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.418 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -133.14 145.69 17.67 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.467 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 135.69 -154.26 21.71 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.187 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -88.53 120.46 70.32 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -56.01 -27.27 63.31 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.99 2.46 . . . . 0.0 112.859 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.29 -42.64 75.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.706 0.289 . . . . 0.0 110.43 176.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.723 HD23 ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.716 174.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.559 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 8.8 m -63.07 -56.23 18.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.506 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -38.11 84.91 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.602 -174.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.53 -41.8 92.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.216 177.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.82 -38.98 87.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.021 177.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 17.8 mt -57.1 -51.35 69.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.929 0.395 . . . . 0.0 110.859 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.44 -44.01 92.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.033 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.446 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.74 -40.42 95.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.443 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.93 -33.8 76.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.73 0.3 . . . . 0.0 111.293 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.42 -26.32 60.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.01 0.433 . . . . 0.0 110.635 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.453 HD13 ' HA ' ' A' ' 76' ' ' LEU . 1.3 mm? -88.01 -31.92 19.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.701 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.99 170.63 12.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.354 0.597 . . . . 0.0 111.821 -176.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -114.87 106.3 14.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.552 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.648 HD13 HD21 ' A' ' 54' ' ' LEU . 3.6 mp -103.77 110.4 63.86 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.9 Cg_exo -69.63 153.25 69.78 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.842 2.361 . . . . 0.0 112.558 -175.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -70.54 126.99 92.39 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.501 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.94 112.32 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.954 2.436 . . . . 0.0 113.218 -175.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -77.52 -21.34 11.6 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.62 2.213 . . . . 0.0 111.33 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -97.66 143.25 28.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.074 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.8 mm-40 -72.17 -27.62 62.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.758 0.313 . . . . 0.0 110.862 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.57 -52.03 65.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.284 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.417 ' O ' ' HB2' ' A' ' 91' ' ' PHE . 53.3 t -67.49 -37.15 78.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.627 177.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.472 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 4.8 t80 -53.72 -50.87 64.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.355 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.29 -27.12 47.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.093 -174.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.2 t -87.19 -43.01 15.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.896 -0.321 . . . . 0.0 111.507 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 48' ' ' LEU . 2.5 m-85 -77.8 -0.87 28.78 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -174.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 88' ' ' TYR . 8.5 mttt -57.29 -30.35 64.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.214 0.53 . . . . 0.0 110.478 176.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.528 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 2.8 t-20 -158.3 76.08 0.75 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.465 172.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -107.68 95.35 14.06 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.342 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.528 ' HD3' ' O ' ' A' ' 93' ' ' ASN . 8.0 Cg_exo -73.6 104.5 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.651 2.234 . . . . 0.0 110.448 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.8 130.47 46.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.783 -173.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.896 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 32.9 t70 -75.13 102.1 4.81 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -70.38 116.98 11.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.37 0.605 . . . . 0.0 110.48 -175.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 4.7 tttt -131.62 128.05 21.67 Favored Pre-proline 0 C--N 1.312 -1.046 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.655 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 99' ' ' LYS . 3.2 Cg_exo . . . . . 0 C--N 1.349 0.6 0 C-N-CA 124.861 3.707 . . . . 0.0 111.837 177.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.476 HG12 HG23 ' A' ' 87' ' ' VAL . 52.8 mt . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.556 0.217 . . . . 0.0 111.45 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.69 -39.97 86.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.987 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -71.96 -41.47 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.037 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.9 -40.02 96.28 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.423 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -62.76 -37.33 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.783 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.24 -39.58 43.69 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.386 178.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -62.68 -26.46 68.67 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.285 0.234 . . . . 0.0 111.429 -178.291 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 20' ' ' ALA . 65.2 mt -62.91 -39.22 84.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.233 0.539 . . . . 0.0 110.03 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -74.07 -28.99 61.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.179 178.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -67.7 -39.33 84.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.725 0.298 . . . . 0.0 110.691 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.76 -31.78 68.67 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.476 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.618 HG23 ' HB3' ' A' ' 73' ' ' ALA . 43.2 mt -66.18 -31.65 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.665 -176.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.69 -33.1 68.53 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.108 -0.37 . . . . 0.0 111.108 179.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.24 4.8 1.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.761 178.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 1.6 mmmt -119.36 -0.54 10.92 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.478 ' CE2' ' HB1' ' A' ' 69' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.572 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.384 -176.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.434 ' HB2' HD22 ' A' ' 66' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.301 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.1 m -118.13 121.2 39.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.911 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.452 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 6.0 t -115.91 151.09 36.0 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -137.56 102.2 4.7 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 0.0 110.387 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.14 136.12 41.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.409 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.794 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 ptm180 -85.21 124.91 32.4 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -127.7 111.09 23.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 121.167 0.508 . . . . 0.0 111.168 -173.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 92' ' ' LYS . 29.1 ttmt -108.0 104.22 13.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.373 -0.83 . . . . 0.0 108.891 176.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 tp -96.37 142.55 28.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.145 0.498 . . . . 0.0 111.898 -173.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.617 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.19 166.13 13.24 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.824 176.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.617 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 25.8 Cg_endo -61.81 -10.15 16.28 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.756 2.304 . . . . 0.0 112.703 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.35 -6.61 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.477 177.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 81' ' ' LYS . . . 78.36 16.92 78.8 Favored Glycine 0 CA--C 1.51 -0.25 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.89 -177.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -104.84 146.25 29.26 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -90.12 101.74 14.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -28.06 60.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.094 0.473 . . . . 0.0 110.07 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.593 ' HB3' ' HB3' ' A' ' 47' ' ' LYS . 28.7 t70 -128.93 104.15 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.538 175.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -133.76 111.74 15.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.34 148.09 15.19 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.408 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.617 ' HD3' HD11 ' A' ' 71' ' ' LEU . 39.3 Cg_endo -70.34 112.91 3.3 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 121.964 1.776 . . . . 0.0 111.656 177.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -73.45 -34.85 65.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.411 0.624 . . . . 0.0 109.589 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 176.88 -177.23 48.2 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.401 177.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.25 -150.84 17.43 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.013 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.3 112.55 42.3 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.784 0.326 . . . . 0.0 110.303 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.46 -40.26 82.54 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.339 2.693 . . . . 0.0 113.399 -174.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.0 -46.71 86.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.951 0.405 . . . . 0.0 111.188 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.434 HD22 ' HB2' ' A' ' 40' ' ' LYS . 16.3 tp -65.61 -38.9 90.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.553 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.551 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 24.9 m -67.93 -44.72 76.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.265 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.718 ' HA ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -62.17 -38.77 90.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.702 0.286 . . . . 0.0 110.822 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.478 ' HB1' ' CE2' ' A' ' 31' ' ' PHE . . . -60.73 -44.76 96.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.642 178.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.3 82.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.075 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 68' ' ' GLN . 51.7 mt -53.52 -46.64 70.18 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.708 -177.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.13 -37.24 46.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.618 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -75.64 -39.6 57.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.112 -175.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -32.01 73.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -176.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -67.91 -30.56 69.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.0 110.966 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 57.3 mt -98.23 -2.59 39.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.541 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -78.02 149.07 34.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.442 -179.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.95 66.45 6.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -178.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 53.4 mt -78.51 116.71 61.53 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.878 176.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 23.4 Cg_exo -67.29 151.53 80.66 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 123.011 2.474 . . . . 0.0 112.761 -175.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.508 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -73.86 138.62 76.52 Favored Pre-proline 0 N--CA 1.443 -0.821 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.453 175.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.04 106.92 0.22 Allowed 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.114 2.543 . . . . 0.0 112.835 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -77.16 -25.1 8.96 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.601 2.201 . . . . 0.0 111.832 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.42 135.26 54.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.695 177.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -66.51 -27.83 68.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.956 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.4 -37.26 86.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.141 0.496 . . . . 0.0 110.75 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.476 HG23 HG12 ' A' ' 16' ' ' ILE . 0.8 OUTLIER -71.99 -33.92 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.292 177.57 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -69.66 -31.63 69.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.514 176.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.898 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -65.9 -35.38 80.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.396 179.295 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t -79.69 -45.89 22.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.566 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.29 5.32 8.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.178 -176.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.898 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 6.1 ttmt -63.7 -23.69 67.47 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.229 0.538 . . . . 0.0 110.117 176.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -170.07 75.15 0.08 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.292 175.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.453 ' HB2' ' O ' ' A' ' 90' ' ' VAL . . . -122.09 85.2 46.02 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.452 -173.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.794 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 12.6 Cg_exo -73.05 104.51 1.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.747 2.298 . . . . 0.0 110.725 178.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 41.6 mt -95.24 158.84 15.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.823 -172.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -80.07 146.67 31.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.258 177.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.452 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 64.7 t80 -129.55 130.84 46.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.029 0.443 . . . . 0.0 110.507 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 165.6 34.23 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo . . . . . 0 C--N 1.344 0.333 0 C-N-CA 122.406 2.07 . . . . 0.0 113.202 -178.013 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -99.43 -8.77 24.27 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.641 -172.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.618 ' HD2' HG23 ' A' ' 6' ' ' THR . 32.1 m-85 67.81 174.78 0.27 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.9 176.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.49 -15.39 53.28 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -159.27 94.53 1.19 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.074 0.464 . . . . 0.0 109.779 178.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.618 HG23 ' HD2' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -84.26 -30.68 25.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.01 -176.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.23 -68.58 0.32 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.235 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -153.42 65.78 0.76 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.341 0.591 . . . . 0.0 109.658 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -131.45 -178.41 4.84 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.031 -178.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 113.81 2.62 23.84 Favored Glycine 0 N--CA 1.445 -0.748 0 C-N-CA 120.583 -0.817 . . . . 0.0 111.397 -176.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -165.67 23.25 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.878 0.371 . . . . 0.0 110.638 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.42 -22.94 21.19 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.995 0.426 . . . . 0.0 110.854 -178.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.567 ' HA2' HD12 ' A' ' 16' ' ' ILE . . . 116.29 -48.78 0.91 Allowed Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.666 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.08 -18.57 65.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.751 0.31 . . . . 0.0 111.174 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -47.33 62.06 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.813 175.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.567 HD12 ' HA2' ' A' ' 13' ' ' GLY . 2.5 mt -68.77 -39.49 80.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.225 176.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -62.91 -26.88 69.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.91 178.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -35.99 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.256 177.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.07 -31.11 69.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.469 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.31 64.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.288 0.566 . . . . 0.0 109.879 173.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.21 -32.28 72.39 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.833 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.449 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -60.06 -30.16 69.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.98 0.39 . . . . 0.0 110.894 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.552 ' O ' HG13 ' A' ' 27' ' ' ILE . 2.6 mt -76.36 -35.12 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.024 0.44 . . . . 0.0 109.954 176.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -62.28 -46.53 88.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.002 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.0 -34.46 75.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.232 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.39 -32.45 72.38 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.391 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 23' ' ' ILE . 8.5 mt -67.97 -32.81 57.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.707 -176.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.489 ' OE1' ' HB2' ' A' ' 101' ' ' HIS . 0.1 OUTLIER -65.15 -40.08 93.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.639 0.257 . . . . 0.0 111.208 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.41 14.13 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -119.26 -8.55 10.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 176.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -122.71 -64.73 1.16 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.723 176.076 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.549 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 0.2 OUTLIER 161.44 -154.87 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 -177.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -86.62 23.59 1.63 Allowed 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 160.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.533 ' H ' ' HB3' ' A' ' 32' ' ' TYR . . . -78.03 -35.44 49.77 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 112.925 -1.943 . . . . 0.0 109.942 176.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.9 -17.48 64.92 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.497 176.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.6 m -81.72 65.77 6.99 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.034 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.41 -142.63 0.1 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.462 175.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.659 ' HA ' ' HG2' ' A' ' 100' ' ' PRO . . . -176.13 157.28 1.8 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.853 0.359 . . . . 0.0 111.049 172.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.15 30.52 69.62 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.876 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.467 ' HB2' HD22 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -135.06 162.78 31.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.895 0.379 . . . . 0.0 110.876 -179.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -141.14 139.66 33.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.785 176.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.623 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 52.8 t -138.05 79.6 1.75 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.47 0.652 . . . . 0.0 110.823 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -70.14 120.99 16.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.012 176.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.585 HD23 ' HA ' ' A' ' 59' ' ' PRO . 67.0 mt -113.64 124.56 52.62 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.91 0.386 . . . . 0.0 110.666 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -81.02 88.17 5.96 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.3 pt -113.89 152.96 15.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.447 -174.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 56' ' ' ASP . 5.0 mtmt -140.33 112.62 7.81 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.375 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 2.3 tp -95.55 118.65 32.65 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 120.915 0.388 . . . . 0.0 110.952 -177.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.621 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -67.57 159.05 80.47 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.979 176.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.471 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 37.4 Cg_exo -57.04 -15.91 19.15 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.864 2.376 . . . . 0.0 112.777 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.83 -0.93 57.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.327 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.52 52.94 4.89 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.52 -0.848 . . . . 0.0 112.426 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.71 140.61 23.78 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.16 107.54 17.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.006 0.431 . . . . 0.0 110.657 -178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.621 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -76.6 -37.37 56.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.902 177.54 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.616 ' HB2' ' HB2' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -112.7 140.15 47.72 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.885 178.723 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -158.82 106.3 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.364 0.602 . . . . 0.0 110.128 177.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.402 ' HG3' ' HD2' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -140.43 127.05 12.02 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.191 -175.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.585 ' HA ' HD23 ' A' ' 44' ' ' LEU . 64.1 Cg_endo -76.62 111.08 3.18 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.701 2.267 . . . . 0.0 112.422 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -124.17 21.46 8.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.736 0.779 . . . . 0.0 109.957 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.45 ' HA2' ' HB ' ' A' ' 43' ' ' THR . . . -79.81 -151.84 7.04 Favored Glycine 0 C--N 1.32 -0.345 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.368 -177.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -115.85 -13.02 8.87 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.822 -0.704 . . . . 0.0 113.2 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -117.63 112.46 38.93 Favored Pre-proline 0 C--N 1.327 -0.403 0 O-C-N 122.551 -0.381 . . . . 0.0 110.466 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.445 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 36.7 Cg_endo -68.96 -27.38 30.43 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.691 2.261 . . . . 0.0 112.886 -176.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -77.71 -51.74 10.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.735 0.302 . . . . 0.0 110.85 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.467 HD22 ' HB2' ' A' ' 40' ' ' LYS . 12.8 tp -56.87 -44.05 81.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.387 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.2 m -69.76 -38.89 76.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.914 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.445 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 1.3 mp0 -62.18 -40.83 97.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.011 0.434 . . . . 0.0 110.888 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.32 -34.72 55.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.032 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.62 -37.94 76.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.812 -178.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 22.0 mt -55.3 -44.03 75.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.771 0.32 . . . . 0.0 111.198 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.41 46.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.267 -178.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.83 91.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.554 -177.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.33 79.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 111.196 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.4 mttt -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.007 0.432 . . . . 0.0 110.967 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 mt -92.27 -3.6 55.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.694 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.459 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -80.08 168.3 19.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.84 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -100.56 106.63 18.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 110.906 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mp -119.35 116.89 33.44 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.104 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -78.96 172.44 14.95 Favored 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 122.733 2.289 . . . . 0.0 113.066 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 124.33 89.78 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.195 178.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.488 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 68.7 Cg_exo -53.61 114.99 2.02 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.236 2.624 . . . . 0.0 112.646 -178.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 7.2 Cg_endo -92.14 -75.57 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.351 2.701 . . . . 0.0 112.903 -174.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.35 134.63 56.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.804 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.77 -36.48 74.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.49 -176.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.01 -47.36 83.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.829 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 83.7 t -66.72 -43.62 89.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.441 178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.471 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 6.1 t80 -60.87 -41.58 96.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.116 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.452 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 16.4 mm-40 -62.92 -24.77 68.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 0.0 111.234 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.406 HG12 ' HB2' ' A' ' 94' ' ' ALA . 93.3 t -92.43 -45.01 14.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.624 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.406 ' HD1' ' HA ' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -59.95 -30.47 69.1 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -175.228 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 48' ' ' LEU . 3.1 ptpt -66.27 -8.22 23.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.731 0.3 . . . . 0.0 111.602 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -164.38 59.94 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.914 0.387 . . . . 0.0 110.114 176.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.406 ' HB2' HG12 ' A' ' 90' ' ' VAL . . . -115.75 89.2 22.72 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.171 -178.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.546 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 2.3 Cg_endo -76.1 103.14 1.69 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 122.07 1.847 . . . . 0.0 110.399 175.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 10.0 mt -102.75 153.24 20.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.973 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.573 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -94.38 132.35 39.1 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.023 175.121 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.623 ' O ' ' HB3' ' A' ' 42' ' ' CYS . 82.4 m-85 -113.98 98.92 7.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.473 0.654 . . . . 0.0 110.075 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.681 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -112.23 173.99 2.57 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.608 177.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.681 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 35.5 Cg_exo -37.27 119.94 0.29 Allowed 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 123.092 2.528 . . . . 0.0 112.855 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.489 ' HB2' ' OE1' ' A' ' 28' ' ' GLU . 2.5 m80 -91.45 157.28 17.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.736 -172.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.7 p80 . . . . . 0 C--O 1.242 0.681 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.568 -177.258 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 121.408 0.623 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.588 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 0.5 OUTLIER -77.9 140.87 39.32 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.524 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -106.83 49.04 0.81 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.029 0.442 . . . . 0.0 110.236 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.19 -136.26 32.36 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 -175.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -144.45 124.72 13.77 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.67 0.271 . . . . 0.0 110.52 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.9 m 65.93 77.66 0.29 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.677 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -90.78 36.67 0.9 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.408 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -125.38 154.27 42.14 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.18 -177.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.7 t-20 -163.75 95.2 0.79 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.974 0.416 . . . . 0.0 110.115 178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.15 -165.55 11.94 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.978 -177.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -162.56 178.43 8.57 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.07 125.89 28.09 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.306 178.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 99.33 40.73 3.16 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -173.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 18' ' ' ASN . . . -60.86 -27.54 68.19 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 122.421 0.288 . . . . 0.0 111.526 -178.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -59.69 -55.64 31.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.193 0.521 . . . . 0.0 110.567 178.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -70.16 -42.74 79.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.121 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.32 -29.84 71.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.623 -177.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 21.8 t-20 -62.37 -46.22 89.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.875 0.369 . . . . 0.0 110.741 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.68 -28.91 51.2 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.831 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.63 -35.99 82.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 110.33 175.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.1 -33.88 84.71 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.796 177.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.28 -45.72 92.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.2 mt -64.82 -45.68 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.798 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -60.33 -35.92 76.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.016 0.436 . . . . 0.0 110.948 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -72.81 -40.55 65.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.04 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.501 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.5 -38.48 77.74 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.739 0.78 . . . . 0.0 110.631 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.544 HG23 ' HB3' ' A' ' 73' ' ' ALA . 8.5 mt -66.04 -43.44 92.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.262 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.525 ' CG ' ' HB2' ' A' ' 35' ' ' SER . 0.8 OUTLIER -76.12 -22.12 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -178.082 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -26.21 60.78 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.839 177.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.446 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.32 -51.9 7.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.891 174.757 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.825 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 4.1 m-85 -97.9 75.61 2.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.057 0.456 . . . . 0.0 110.006 177.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.24 -51.6 63.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.451 -1.249 . . . . 0.0 113.62 -170.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -102.93 -9.77 19.57 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 122.587 1.184 . . . . 0.0 110.968 -173.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.825 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -79.32 -56.55 4.26 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 113.445 -1.707 . . . . 0.0 111.824 177.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.525 ' HB2' ' CG ' ' A' ' 28' ' ' GLU . 46.4 m -73.41 -15.48 61.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.518 -173.152 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 p -87.97 49.12 1.74 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.135 0.493 . . . . 0.0 110.732 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -86.94 -65.86 0.97 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.661 -175.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.778 ' H ' ' HB2' ' A' ' 100' ' ' PRO . . . 72.26 173.56 0.3 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.807 -173.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.64 -50.78 4.47 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.9 -177.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.426 ' HB2' HD22 ' A' ' 66' ' ' LEU . 8.9 mmtp -97.49 165.79 11.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.827 0.346 . . . . 0.0 111.234 -177.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.18 156.78 44.73 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.287 176.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.71 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 8.2 t -142.52 151.39 41.58 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.0 m -125.16 103.23 7.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.218 0.532 . . . . 0.0 110.907 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.8 mt -92.59 113.18 25.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.009 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.725 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.3 mmt-85 -81.73 88.17 6.29 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.2 pt -101.04 151.74 5.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.074 -174.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HE2' ' HB3' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -134.7 89.17 2.51 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.92 179.702 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.6 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 1.6 tp -80.74 123.2 28.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.393 -172.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.434 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -74.31 152.29 87.95 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 173.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -57.37 -16.4 22.76 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.053 2.502 . . . . 0.0 112.58 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.88 -14.34 62.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.723 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.05 59.94 2.23 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.807 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.97 146.11 20.21 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.36 82.1 2.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.321 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.477 ' HG ' ' H ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -73.9 -19.57 60.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.243 0.544 . . . . 0.0 109.891 177.801 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.482 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -125.05 117.26 23.57 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.488 177.391 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.5 tt -159.46 111.03 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.499 . . . . 0.0 110.531 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.5 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -137.74 135.05 18.58 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.183 -177.238 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.747 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 2.0 Cg_endo -80.64 74.36 5.58 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.414 2.743 . . . . 0.0 111.308 177.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.611 ' HB2' ' HG3' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -65.37 -34.15 77.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.081 -175.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -144.16 163.38 27.77 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.099 177.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.708 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 109.84 179.77 20.83 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.181 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.11 123.41 87.22 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-O 120.352 0.12 . . . . 0.0 110.797 -179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -53.41 -46.05 36.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.327 2.685 . . . . 0.0 113.234 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.1 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.822 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 100' ' ' PRO . 14.0 tp -59.82 -43.9 94.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.845 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.747 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 92.7 m -64.62 -37.74 88.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.828 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 71' ' ' LEU . 2.4 tt0 -63.07 -40.77 98.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.868 0.366 . . . . 0.0 110.896 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.31 -45.61 92.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.429 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.46 -31.27 70.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.424 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 23.1 mt -55.7 -52.26 64.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.124 0.488 . . . . 0.0 111.328 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -76.86 -36.69 56.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.986 -177.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.544 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -64.05 -46.65 83.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.734 -178.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.33 90.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.708 0.29 . . . . 0.0 111.58 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -71.31 -26.95 63.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.446 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.6 OUTLIER -92.95 -2.42 55.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.739 178.401 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.501 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -90.9 156.99 17.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.282 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -97.5 101.2 12.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.071 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -88.54 115.59 63.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.795 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.31 130.76 35.36 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.537 2.158 . . . . 0.0 112.024 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -59.92 121.16 56.34 Favored Pre-proline 0 N--CA 1.445 -0.713 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.891 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.429 ' CB ' ' HB2' ' A' ' 88' ' ' TYR . 47.0 Cg_exo -39.17 104.62 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 124.307 3.338 . . . . 0.0 114.492 -173.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -83.58 -52.2 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.895 2.397 . . . . 0.0 111.843 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.66 126.46 31.04 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 176.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -66.47 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.167 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.34 -43.22 86.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 174.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.618 HG13 ' HD2' ' A' ' 91' ' ' PHE . 1.8 t -62.48 -42.54 96.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.606 175.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.429 ' HB2' ' CB ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -60.87 -44.51 96.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.001 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.869 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -70.78 -21.24 62.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.543 -175.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 72.4 t -92.53 -55.0 6.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.699 0.285 . . . . 0.0 111.245 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.618 ' HD2' HG13 ' A' ' 87' ' ' VAL . 12.9 m-85 -67.48 -14.95 63.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -173.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.869 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 3.4 pttp -70.31 -6.01 32.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.018 0.437 . . . . 0.0 110.679 177.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -164.93 67.69 0.14 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.103 173.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -136.24 97.85 11.76 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.866 -176.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.725 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 13.2 Cg_exo -72.02 112.6 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.466 2.111 . . . . 0.0 110.262 178.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.455 HD11 ' HE1' ' A' ' 91' ' ' PHE . 11.8 mt -88.54 149.15 23.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.993 -168.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.61 126.51 34.55 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.585 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.71 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 19.4 t80 -98.54 102.8 14.65 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.1 0.476 . . . . 0.0 109.824 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -109.86 100.09 41.45 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 174.861 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.778 ' HB2' ' H ' ' A' ' 38' ' ' ALA . 2.6 Cg_endo -53.76 139.23 68.43 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 123.334 2.689 . . . . 0.0 113.191 -170.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -59.22 160.73 6.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.993 -178.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.1 p80 . . . . . 0 C--O 1.246 0.914 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.423 174.45 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -103.34 135.7 44.48 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 178.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -105.68 94.3 5.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.868 0.366 . . . . 0.0 110.066 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.418 ' O ' ' HB3' ' A' ' 5' ' ' ASN . . . -79.38 62.7 4.04 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.828 -177.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.418 ' HB3' ' O ' ' A' ' 4' ' ' GLY . 4.0 t30 70.29 -60.65 0.48 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.433 0.693 . . . . 0.0 111.945 178.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -15.48 31.61 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 122.352 -0.218 . . . . 0.0 111.441 -176.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 8' ' ' ASN . 0.4 OUTLIER 62.98 80.36 0.23 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.245 -177.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 21.0 t-20 72.63 -70.62 0.16 Allowed 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.272 -177.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -155.35 150.21 26.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.844 0.354 . . . . 0.0 110.583 177.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.56 100.26 0.22 Allowed Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.944 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.39 113.72 3.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.967 0.413 . . . . 0.0 111.006 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.49 -176.6 3.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.832 -178.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 98.9 169.93 31.07 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.492 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -105.95 -67.5 0.92 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.609 0.242 . . . . 0.0 110.55 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -57.42 11.79 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.578 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 95.8 mt -56.87 -44.61 82.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.416 -178.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -65.8 -41.73 91.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.167 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -62.5 -46.06 90.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.467 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.432 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -62.06 -48.11 81.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.772 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -63.66 -29.94 71.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.105 0.478 . . . . 0.0 110.862 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.35 -51.84 20.03 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.524 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 3.6 pt20 -66.12 -26.59 67.52 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.719 HG12 HD12 ' A' ' 79' ' ' ILE . 52.5 mt -64.08 -40.54 89.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 20' ' ' ALA . 3.6 mttp -63.93 -42.07 97.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.298 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.3 m -62.95 -47.18 84.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.942 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.78 -44.59 77.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.282 0.563 . . . . 0.0 110.545 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.2 mt -61.88 -42.0 92.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.378 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.494 ' C ' ' H ' ' A' ' 30' ' ' LYS . 4.0 tm-20 -76.39 -27.7 56.46 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.254 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.3 m -76.9 24.48 0.16 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.561 0.696 . . . . 0.0 110.72 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -133.34 -33.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.739 177.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.778 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 1.0 OUTLIER -113.85 -25.98 8.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.59 -176.461 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 62.02 -121.13 0.71 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.509 0.723 . . . . 0.0 111.901 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -71.56 4.59 2.96 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.665 0.745 . . . . 0.0 112.062 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.778 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -79.02 -46.07 18.91 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 113.84 -1.527 . . . . 0.0 109.805 169.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -21.75 60.31 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.984 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.5 m -81.38 72.19 8.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.569 -0.742 . . . . 0.0 109.812 175.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.769 ' H ' ' HB3' ' A' ' 100' ' ' PRO . 0.4 OUTLIER -92.56 -93.84 0.15 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.041 -171.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.476 ' H ' ' HG2' ' A' ' 100' ' ' PRO . . . -156.5 -167.49 2.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.054 -175.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -80.49 61.97 4.38 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.132 -0.556 . . . . 0.0 112.615 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.05 172.59 7.07 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.37 134.73 31.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.14 92.32 3.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.099 0.476 . . . . 0.0 110.684 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.487 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.3 m -67.04 118.23 10.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 94.0 mt -108.42 118.46 36.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.755 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.3 mtt180 -82.26 89.57 6.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.784 177.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.31 148.13 6.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.795 -173.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.562 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 11.1 mttt -130.18 103.71 6.89 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.988 176.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.24 145.84 25.14 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.086 0.47 . . . . 0.0 111.701 -174.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -96.54 160.9 28.46 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.864 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 27.4 Cg_endo -63.88 0.81 1.79 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.035 2.49 . . . . 0.0 113.319 -178.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -104.12 -2.39 25.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.014 0.435 . . . . 0.0 110.555 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.491 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 97.31 -23.66 34.83 Favored Glycine 0 C--O 1.226 -0.354 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.585 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.9 ptm -73.31 148.98 43.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.746 0.308 . . . . 0.0 110.446 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -85.8 124.79 32.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.808 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.88 -14.7 33.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.167 0.508 . . . . 0.0 109.947 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.562 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 42.4 t0 -160.44 140.08 11.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.919 178.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 5.7 tt -159.25 113.32 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 120.971 0.415 . . . . 0.0 110.321 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HB3' ' HE3' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -141.46 142.08 25.18 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.725 -178.488 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.531 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 14.7 Cg_exo -69.72 128.98 16.84 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.477 ' HB3' ' HB ' ' A' ' 43' ' ' THR . 22.8 tt0 -83.19 -57.91 3.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.575 175.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -156.07 144.46 10.9 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.58 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 158.53 -133.42 3.43 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.384 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -113.52 125.32 29.76 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -52.84 -43.88 52.74 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.98 2.454 . . . . 0.0 112.82 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.81 -52.01 42.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.126 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD21 ' HD3' ' A' ' 100' ' ' PRO . 23.1 tp -57.43 -47.3 82.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.968 0.413 . . . . 0.0 110.97 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.619 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.2 m -63.61 -42.71 98.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.06 -178.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.759 ' HA ' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -63.15 -41.01 99.19 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 120.814 0.34 . . . . 0.0 110.819 179.033 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.452 ' HB1' ' HE2' ' A' ' 31' ' ' PHE . . . -65.7 -42.33 91.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.564 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.53 -37.6 81.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.113 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.759 HD12 ' HA ' ' A' ' 68' ' ' GLN . 24.9 mt -59.82 -50.14 74.96 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.587 178.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.13 97.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.168 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.38 81.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.212 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.75 -27.78 69.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.292 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt -69.32 -34.6 74.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.626 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.492 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -85.95 -28.49 24.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.883 -178.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 126.94 31.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.646 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.1 mtpt -94.85 107.27 19.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.876 -177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.719 HD12 HG12 ' A' ' 23' ' ' ILE . 6.9 mm -81.42 128.22 70.71 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.062 177.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 17.9 Cg_exo -64.93 132.35 31.98 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.747 2.298 . . . . 0.0 111.01 179.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.485 ' HB3' ' HE2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -53.11 128.04 47.54 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.011 -177.094 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 20.4 Cg_endo -64.49 121.32 8.87 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.782 2.321 . . . . 0.0 112.001 -176.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 6.6 Cg_endo -83.91 -69.06 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.926 2.417 . . . . 0.0 112.53 -176.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.22 134.07 55.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.233 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.41 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 2.1 mt-30 -55.12 -40.42 70.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.726 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.46 -50.97 71.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.951 0.405 . . . . 0.0 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.1 -42.02 95.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.973 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.468 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -65.26 -36.01 82.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.395 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 19.8 mm-40 -76.48 -40.29 50.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.0 110.549 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.2 t -64.33 -46.03 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.177 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -76.99 -6.19 51.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.667 -177.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 8.2 mttt -61.32 -23.72 65.92 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.023 0.44 . . . . 0.0 110.258 174.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.48 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.7 OUTLIER -158.11 74.82 0.73 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.968 174.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -116.86 81.95 12.63 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.084 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.755 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.7 Cg_exo -73.41 104.83 1.87 Allowed 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.751 2.3 . . . . 0.0 111.192 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.6 146.34 23.88 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.204 -174.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.487 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -79.18 94.15 5.34 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.447 ' HZ ' HG22 ' A' ' 23' ' ' ILE . 1.1 m-85 -86.14 103.2 14.57 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.628 0.727 . . . . 0.0 110.894 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -109.92 158.21 35.6 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.46 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.769 ' HB3' ' H ' ' A' ' 37' ' ' TYR . 79.0 Cg_exo -53.5 97.66 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.685 2.257 . . . . 0.0 111.582 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -89.29 129.86 35.78 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.521 -170.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 8.7 p-80 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.07 -0.967 . . . . 0.0 109.539 175.378 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.113 0 CA-C-O 120.701 0.286 . . . . 0.0 110.717 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -109.91 148.58 31.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.763 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.14 -103.36 0.38 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.101 0.477 . . . . 0.0 111.421 -178.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.16 94.53 1.08 Allowed Glycine 0 N--CA 1.444 -0.788 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -174.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -83.4 -52.91 6.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.743 0.306 . . . . 0.0 111.611 -171.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.84 91.68 5.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.65 -176.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.08 151.67 4.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.111 177.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -91.34 129.67 37.3 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 177.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.14 115.61 6.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.561 -177.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 146.49 121.83 1.36 Allowed Glycine 0 N--CA 1.443 -0.84 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.956 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.37 -29.68 62.79 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -109.34 174.88 5.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.505 172.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.92 90.61 0.98 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.639 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.3 -38.6 85.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.01 0.434 . . . . 0.0 109.976 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.6 -38.24 90.37 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.027 176.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.504 HD13 HG23 ' A' ' 87' ' ' VAL . 24.6 mm -61.02 -43.46 96.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.65 177.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -44.07 95.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.099 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.435 ' O ' ' HB3' ' A' ' 22' ' ' GLN . 4.5 t-20 -68.45 -32.89 73.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.09 -48.19 45.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.739 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB2' ' HZ ' ' A' ' 91' ' ' PHE . . . -58.2 -49.05 78.41 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.162 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -61.7 -43.02 99.81 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.344 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -60.87 -32.52 71.95 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.655 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.419 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 52.6 mt -67.68 -42.41 86.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.852 0.358 . . . . 0.0 110.362 178.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.534 ' HB3' ' CE1' ' A' ' 101' ' ' HIS . 0.6 OUTLIER -64.81 -40.3 95.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.716 176.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.586 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 12.4 m -64.8 -41.98 95.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.97 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -56.37 -50.42 71.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.5 mt -63.46 -43.85 98.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.5 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.586 ' OE1' ' HA ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -65.61 -26.38 67.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.792 0.33 . . . . 0.0 111.069 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.3 m -76.44 -1.93 29.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.752 0.31 . . . . 0.0 111.093 177.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 6.2 mmtt -115.17 2.14 14.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 0.0 110.636 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.603 ' HB3' ' O ' ' A' ' 33' ' ' ASP . 0.0 OUTLIER -82.32 136.27 35.05 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 178.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -54.61 -60.16 3.73 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.244 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.643 ' HB3' ' HA ' ' A' ' 36' ' ' SER . 5.0 t70 -89.16 149.48 23.13 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 106.085 -1.821 . . . . 0.0 106.085 164.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -46.64 -52.77 12.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 118.241 0.473 . . . . 0.0 110.482 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.741 ' HB3' ' HB2' ' A' ' 102' ' ' HIS . 0.2 OUTLIER -83.18 -44.15 15.36 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.992 172.092 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.643 ' HA ' ' HB3' ' A' ' 33' ' ' ASP . 38.2 m 71.36 -46.27 0.64 Allowed 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.775 0.83 . . . . 0.0 111.67 -173.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -129.43 -176.81 4.01 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -174.41 155.59 2.34 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.579 0.549 . . . . 0.0 110.093 177.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.1 18.43 72.07 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.761 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.29 158.07 43.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.737 0.303 . . . . 0.0 110.439 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.81 HG23 ' HG3' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -122.66 162.14 22.5 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.208 177.633 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.677 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 43.2 t -146.79 142.01 27.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.548 -178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.98 104.27 7.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.517 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.42 125.48 51.03 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.913 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.967 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.4 OUTLIER -74.05 127.81 33.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 173.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.478 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 1.1 pt -129.26 142.3 44.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.073 0.464 . . . . 0.0 110.217 -178.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HB2' ' CB ' ' A' ' 56' ' ' ASP . 7.7 mtpt -133.02 115.29 14.98 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 48' ' ' LEU . 9.1 mt -79.9 130.2 35.11 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.129 0.49 . . . . 0.0 111.574 -173.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.34 158.61 43.25 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.9 176.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -59.75 -13.61 22.89 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.965 2.444 . . . . 0.0 113.361 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -98.79 -6.41 29.33 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.374 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.452 ' O ' ' HB ' ' A' ' 79' ' ' ILE . . . 110.88 -19.8 25.08 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.29 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.36 158.66 27.39 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.921 0.36 . . . . 0.0 111.059 -178.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -88.98 106.94 18.75 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 175.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 pp -72.82 -31.88 65.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.304 -178.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.479 ' CB ' ' HB2' ' A' ' 47' ' ' LYS . 0.4 OUTLIER -118.74 124.8 48.17 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.718 176.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.505 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.1 tp -148.56 106.72 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.246 0.546 . . . . 0.0 109.648 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -147.86 128.45 6.89 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.96 -172.787 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.665 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 12.6 Cg_exo -70.26 92.7 0.56 Allowed 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 123.098 2.532 . . . . 0.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -67.33 -45.8 75.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.484 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -141.82 -179.12 18.61 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.504 -0.638 . . . . 0.0 111.504 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.677 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 102.32 -178.15 26.45 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.64 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.95 121.92 83.3 Favored Pre-proline 0 C--N 1.327 -0.399 0 C-N-CA 122.415 0.286 . . . . 0.0 110.49 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.82 -43.48 54.15 Favored 'Trans proline' 0 CA--C 1.528 0.216 0 C-N-CA 122.79 2.327 . . . . 0.0 112.74 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.19 -38.95 92.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.853 0.359 . . . . 0.0 111.17 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 37.1 tp -71.49 -45.98 61.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.665 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 68.8 m -65.92 -38.99 90.15 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.703 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -64.55 -37.23 86.82 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.819 0.342 . . . . 0.0 110.455 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.07 -37.22 72.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.384 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.99 -27.91 69.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.004 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.5 mt -61.1 -45.31 95.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 110.365 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.25 86.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.621 178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.45 -44.14 92.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.341 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.99 70.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -74.83 -25.98 59.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.339 177.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.0 -13.43 50.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.316 0.579 . . . . 0.0 110.296 177.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -86.28 149.23 25.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.096 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -125.86 91.37 3.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.851 0.357 . . . . 0.0 110.075 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 52' ' ' GLY . 29.2 mm -66.24 127.84 93.49 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.656 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -67.48 153.64 76.0 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.57 2.18 . . . . 0.0 112.263 -175.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.23 122.14 73.7 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.925 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 50.3 Cg_exo -41.34 118.45 0.77 Allowed 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 123.835 3.023 . . . . 0.0 113.879 -174.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 3.1 Cg_endo -79.38 -75.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 123.109 2.539 . . . . 0.0 111.38 177.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.8 124.98 27.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.895 175.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -64.01 -26.97 68.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.58 0.229 . . . . 0.0 111.021 -177.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.02 -25.9 68.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.204 0.526 . . . . 0.0 110.969 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.504 HG23 HD13 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -77.65 -30.65 16.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.795 178.767 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -78.6 -38.0 41.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.271 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 25.7 pt-20 -67.76 -18.67 64.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.87 0.367 . . . . 0.0 110.877 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.4 t -92.07 -49.54 13.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.681 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.565 ' HZ ' ' HB2' ' A' ' 20' ' ' ALA . 22.4 m-85 -87.81 26.24 1.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.1 ttmt -73.08 -31.07 64.13 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.082 0.468 . . . . 0.0 110.27 177.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.447 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 12.5 p-10 -151.87 38.47 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.106 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -102.85 103.63 34.46 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.967 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.9 Cg_exo -72.25 155.11 56.53 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.886 2.391 . . . . 0.0 112.037 -174.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.471 ' HA ' HD22 ' A' ' 96' ' ' LEU . 0.1 OUTLIER -99.19 132.44 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.294 -172.665 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -92.19 120.07 32.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.98 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -117.02 142.49 46.9 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.382 0.611 . . . . 0.0 111.723 -172.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.81 ' HG3' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -145.18 143.56 20.79 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.532 174.226 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.55 107.38 0.2 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.665 2.243 . . . . 0.0 111.737 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.534 ' CE1' ' HB3' ' A' ' 24' ' ' LYS . 1.2 m170 -68.2 95.67 0.59 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.459 0.647 . . . . 0.0 111.748 -173.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.741 ' HB2' ' HB3' ' A' ' 35' ' ' SER . 16.0 t-80 . . . . . 0 C--O 1.251 1.169 0 CA-C-O 117.867 -1.063 . . . . 0.0 109.014 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.067 0 CA-C-O 120.733 0.301 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.792 ' HG2' ' H ' ' A' ' 4' ' ' GLY . 0.0 OUTLIER -92.16 -27.96 17.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.839 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 66.48 22.65 10.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.762 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.792 ' H ' ' HG2' ' A' ' 2' ' ' GLU . . . 43.99 -109.28 0.24 Allowed Glycine 0 C--N 1.337 0.63 0 O-C-N 123.882 0.739 . . . . 0.0 113.218 177.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -109.18 102.49 11.44 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.42 -2.13 36.9 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.559 -178.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' A' ' 8' ' ' ASN . 18.6 mtmt -79.29 122.25 26.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.546 175.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.506 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 3.4 t30 74.81 100.68 0.07 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.775 0.798 . . . . 0.0 110.053 -174.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -137.76 21.94 2.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.737 -177.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.62 58.74 4.71 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.382 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.93 124.89 52.85 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.367 -0.234 . . . . 0.0 110.367 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.481 ' HB2' ' H ' ' A' ' 13' ' ' GLY . 0.7 OUTLIER 54.94 -95.47 0.05 Allowed 'General case' 0 CA--C 1.538 0.484 0 O-C-N 123.979 0.799 . . . . 0.0 111.85 -179.538 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.481 ' H ' ' HB2' ' A' ' 12' ' ' SER . . . -148.19 59.55 0.46 Allowed Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.454 ' HA ' ' HB3' ' A' ' 17' ' ' ASN . . . -70.78 -11.07 60.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.474 0.178 . . . . 0.0 111.386 -178.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -75.4 -41.16 56.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.983 0.421 . . . . 0.0 110.124 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.416 HG23 HG13 ' A' ' 87' ' ' VAL . 1.7 mt -71.64 -39.62 69.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.056 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.454 ' HB3' ' HA ' ' A' ' 14' ' ' ALA . 1.5 t-20 -66.17 -32.02 73.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.681 178.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -62.17 -43.84 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 177.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.483 ' O ' HG13 ' A' ' 23' ' ' ILE . 11.3 t80 -62.54 -48.36 79.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 177.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.63 -45.64 85.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 111.293 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.36 -35.9 90.87 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.489 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -66.97 -38.96 87.03 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.465 0.172 . . . . 0.0 111.465 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 19' ' ' TYR . 14.1 mt -63.17 -43.14 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.436 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -62.81 -40.19 96.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.722 177.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.2 m -70.26 -34.24 72.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.924 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.637 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -61.09 -40.57 94.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.007 0.432 . . . . 0.0 110.752 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.474 HG23 ' HB3' ' A' ' 73' ' ' ALA . 37.7 mt -66.18 -37.91 80.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.641 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.634 ' HG2' ' H ' ' A' ' 33' ' ' ASP . 1.4 tm-20 -72.98 -20.79 60.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.905 176.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 48.8 m -74.24 -7.94 54.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.215 0.531 . . . . 0.0 110.7 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.644 ' HD2' ' HB2' ' A' ' 76' ' ' LEU . 2.5 mmtm -114.21 -27.16 7.74 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.034 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.749 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 2.5 m-85 -123.37 85.55 2.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.41 174.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -47.49 90.6 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.989 0.805 . . . . 0.0 112.612 -175.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.634 ' H ' ' HG2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER 53.24 17.64 1.06 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.016 0.926 . . . . 0.0 111.319 -176.544 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.749 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -81.36 -56.16 4.24 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.506 -177.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.921 ' HB2' ' HZ ' ' A' ' 98' ' ' PHE . 1.2 p -69.9 -27.75 65.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.567 0.699 . . . . 0.0 109.93 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.3 m -80.54 82.68 6.5 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.575 177.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' A' ' 38' ' ' ALA . 0.1 OUTLIER -81.76 -117.78 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.392 -178.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.424 ' H ' ' HB3' ' A' ' 37' ' ' TYR . . . -172.68 147.36 1.77 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.514 0.197 . . . . 0.0 110.983 177.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.18 -52.46 4.64 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.358 -0.449 . . . . 0.0 113.128 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -80.13 151.53 29.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.774 0.321 . . . . 0.0 111.559 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.525 HG23 ' HB2' ' A' ' 99' ' ' LYS . 1.0 OUTLIER -131.87 153.12 50.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.103 176.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 117.32 12.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.879 0.371 . . . . 0.0 110.959 -178.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.7 m -84.9 104.8 15.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.789 0.328 . . . . 0.0 110.465 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.0 mt -93.49 114.0 26.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.239 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.619 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 10.6 ttm180 -74.52 96.16 2.89 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.2 pt -117.59 113.78 43.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.382 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.525 ' HG2' HD21 ' A' ' 55' ' ' LEU . 3.2 tttt -97.91 111.72 23.92 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.548 HD13 ' HD2' ' A' ' 91' ' ' PHE . 2.2 mt -94.8 124.86 39.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.0 0.428 . . . . 0.0 110.888 -174.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.61 152.92 95.23 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.011 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.08 -20.17 44.57 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.177 2.584 . . . . 0.0 113.472 -176.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -83.82 -4.03 58.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.699 0.285 . . . . 0.0 111.077 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.81 44.45 4.83 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.608 176.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.431 ' O ' ' HG3' ' A' ' 53' ' ' MET . 0.0 OUTLIER -139.39 142.39 37.53 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 177.221 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.83 96.83 7.12 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.777 0.322 . . . . 0.0 110.151 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.525 HD21 ' HG2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -73.01 -35.17 66.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.023 0.44 . . . . 0.0 110.14 -178.71 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.446 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 34.3 t0 -126.62 101.84 6.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.217 177.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.1 tt -127.99 111.36 24.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.06 0.457 . . . . 0.0 110.294 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.2 OUTLIER -153.79 141.8 13.94 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.172 -177.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.443 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 20.6 Cg_exo -64.8 124.68 13.52 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.459 2.106 . . . . 0.0 111.865 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.15 -54.57 4.93 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -162.07 144.61 9.87 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 177.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 157.32 -130.03 2.53 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.501 -178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.6 121.59 25.79 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.551 0.215 . . . . 0.0 110.56 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -46.72 -45.0 20.98 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 123.596 2.864 . . . . 0.0 113.431 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.59 -52.11 65.75 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.716 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.455 ' HG ' ' CE2' ' A' ' 98' ' ' PHE . 9.2 tp -66.22 -42.64 88.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 4.0 m -63.51 -42.19 98.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.595 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -65.87 -39.8 91.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.28 -39.07 91.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.291 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.46 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . . . -67.32 -46.31 73.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.723 176.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.411 HD11 ' HD3' ' A' ' 59' ' ' PRO . 1.4 mt -55.06 -46.09 75.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.012 0.434 . . . . 0.0 111.026 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.85 88.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.728 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.474 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -81.98 -41.57 20.58 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -176.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.67 -32.96 72.14 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.63 61.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.169 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.644 ' HB2' ' HD2' ' A' ' 30' ' ' LYS . 1.9 mt -90.62 -25.43 20.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 110.566 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.637 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -64.44 138.64 58.52 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.636 -174.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 81.1 2.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.331 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.478 HG12 HG23 ' A' ' 23' ' ' ILE . 2.3 mp -71.44 126.17 91.76 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.552 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.7 Cg_exo -66.8 177.66 3.34 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 123.08 2.52 . . . . 0.0 112.007 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 142.92 31.09 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.271 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.448 ' HA ' ' HD2' ' A' ' 83' ' ' PRO . 6.5 Cg_endo -48.68 118.27 3.28 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.401 2.734 . . . . 0.0 112.223 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' A' ' 82' ' ' PRO . 18.2 Cg_endo -63.57 -29.01 70.12 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.089 2.526 . . . . 0.0 113.313 -175.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.22 159.48 40.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.853 0.358 . . . . 0.0 111.278 -177.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -62.76 -34.75 77.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.12 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.19 -37.9 81.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.416 HG13 HG23 ' A' ' 16' ' ' ILE . 2.2 t -74.63 -26.87 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.866 178.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.3 OUTLIER -61.59 -37.94 85.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.498 178.23 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -72.44 -35.33 68.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.2 t -70.38 -54.54 18.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.579 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.548 ' HD2' HD13 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -71.01 9.23 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -174.628 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.504 ' HD2' ' O ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -75.04 -25.4 58.68 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.111 -0.368 . . . . 0.0 111.227 177.444 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -173.74 34.64 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.667 0.27 . . . . 0.0 111.628 -177.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -102.54 113.05 66.08 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 120.823 0.344 . . . . 0.0 110.691 176.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.619 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 20.1 Cg_exo -72.83 144.72 39.41 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 123.052 2.501 . . . . 0.0 111.542 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 96' ' ' LEU . 0.8 OUTLIER -91.69 142.87 27.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.942 0.401 . . . . 0.0 111.495 -174.869 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.83 97.19 9.59 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.454 173.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.921 ' HZ ' ' HB2' ' A' ' 35' ' ' SER . 57.6 t80 -79.3 107.4 12.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.454 0.645 . . . . 0.0 110.596 -177.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.596 ' HG2' ' HD2' ' A' ' 100' ' ' PRO . 5.3 ttpt -150.03 148.89 26.09 Favored Pre-proline 0 C--N 1.311 -1.086 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.596 ' HD2' ' HG2' ' A' ' 99' ' ' LYS . 23.8 Cg_exo -31.61 119.64 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 124.202 3.268 . . . . 0.0 112.564 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.536 ' O ' ' HB2' ' A' ' 102' ' ' HIS . 2.5 p80 -45.19 138.56 3.86 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.121 -0.945 . . . . 0.0 113.219 -168.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.536 ' HB2' ' O ' ' A' ' 101' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.278 0 CA-C-N 113.994 -1.457 . . . . 0.0 110.062 -174.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.909 0 CA-C-O 120.284 0.087 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.62 94.14 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.977 0.798 . . . . 0.0 111.786 178.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -146.6 -173.78 4.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.992 177.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -95.35 7.97 69.15 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.294 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.9 t30 65.57 22.11 11.74 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.122 0.487 . . . . 0.0 110.808 -179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.07 51.8 2.03 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.303 0.573 . . . . 0.0 111.016 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.93 57.86 1.33 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.034 179.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -138.99 144.84 39.09 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.377 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -159.54 144.11 15.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.119 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.26 -176.02 38.36 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.478 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -104.43 -44.17 4.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.171 0.51 . . . . 0.0 109.944 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 m -80.88 145.41 31.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.225 172.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 114.78 -21.27 14.12 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.076 -173.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.44 -23.69 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 174.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -46.53 76.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.575 174.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.0 mt -64.01 -43.15 97.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.403 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -60.48 -33.21 72.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.862 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.465 ' O ' ' HG2' ' A' ' 22' ' ' GLN . 17.4 t-20 -74.69 -47.77 29.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.687 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -68.27 -37.73 81.01 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.205 -176.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.94 -27.19 64.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.432 0.634 . . . . 0.0 109.459 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.73 -27.86 73.57 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.052 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 18' ' ' ASN . 50.8 mm-40 -63.4 -33.31 75.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.049 0.452 . . . . 0.0 109.966 176.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.432 HD12 HG23 ' A' ' 79' ' ' ILE . 7.8 mm -77.26 -42.27 30.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.656 176.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.459 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 4.7 mtpm? -58.88 -53.85 53.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.338 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.8 m -59.75 -33.08 71.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.657 0.265 . . . . 0.0 111.292 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.3 -50.13 71.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 175.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.637 HG23 ' HB1' ' A' ' 73' ' ' ALA . 74.7 mt -68.3 -32.62 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.206 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.434 ' HG3' ' CD2' ' A' ' 101' ' ' HIS . 0.0 OUTLIER -65.55 -20.66 66.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.951 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.44 14.86 28.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.987 177.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.422 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.2 OUTLIER -148.89 33.3 0.76 Allowed 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.14 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.448 ' HB2' ' HB3' ' A' ' 34' ' ' ALA . 14.3 p90 -70.17 -29.4 66.28 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 113.756 -1.566 . . . . 0.0 112.676 -167.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 1.7 m-85 71.1 -72.24 0.12 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -169.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -149.84 24.94 0.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.708 0.766 . . . . 0.0 109.905 168.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.521 ' O ' ' HA ' ' A' ' 100' ' ' PRO . . . -73.8 -29.83 62.39 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.073 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.872 ' HA ' ' HB2' ' A' ' 101' ' ' HIS . 73.6 m -77.56 -17.69 57.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.188 0.518 . . . . 0.0 110.731 -178.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m -109.46 -73.27 0.69 Allowed 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.06 -177.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 37.23 -107.57 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.891 0.877 . . . . 0.0 112.618 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -154.56 -119.32 0.03 OUTLIER 'General case' 0 C--O 1.227 -0.129 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -130.5 36.41 2.3 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.426 -176.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.54 ' O ' ' HD2' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -88.56 176.92 6.93 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.537 0.208 . . . . 0.0 110.572 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.448 ' HA ' ' HB3' ' A' ' 99' ' ' LYS . 23.7 m -153.95 115.83 4.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.56 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.5 OUTLIER -121.16 177.97 4.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.147 -178.571 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.8 m -148.89 122.24 9.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.202 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.491 HD11 ' HB1' ' A' ' 70' ' ' ALA . 18.8 mt -94.23 113.55 25.49 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.569 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.691 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 tmm_? -78.15 89.44 4.25 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 175.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -102.37 136.67 33.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.051 -173.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.61 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -114.63 100.15 8.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.319 177.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.3 tp -86.34 126.41 34.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.202 -174.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.658 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -76.92 167.74 34.12 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.246 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.658 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 6.7 Cg_endo -52.66 -37.96 75.71 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.162 2.575 . . . . 0.0 113.657 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -74.01 -10.7 59.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.948 0.404 . . . . 0.0 111.406 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 97.73 11.58 50.03 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.032 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ptm -98.94 146.71 25.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.472 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -77.48 109.59 11.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.77 0.319 . . . . 0.0 110.306 -179.09 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.61 -21.23 30.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.374 0.607 . . . . 0.0 109.893 178.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.61 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 48.1 t0 -149.3 135.55 19.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.106 178.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.7 tt -153.89 113.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.221 0.534 . . . . 0.0 110.372 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.6 tttp -151.85 132.61 7.54 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.084 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.53 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 50.8 Cg_exo -55.44 125.41 19.05 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.713 2.275 . . . . 0.0 112.214 -179.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -77.31 -53.53 7.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.965 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -174.39 151.76 13.3 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.038 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.56 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 149.88 -101.67 0.22 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.808 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.576 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 12.6 t70 -141.42 129.44 12.06 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 -178.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -56.33 -40.65 83.3 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.362 2.708 . . . . 0.0 113.432 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.07 -38.3 63.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.928 0.394 . . . . 0.0 110.984 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -66.58 -50.21 63.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.551 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.654 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.3 m -69.45 -21.91 63.69 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.509 -177.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -67.74 -50.55 56.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.15 -31.47 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.377 177.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.491 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -56.44 -46.19 80.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.45 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 6.4 mt -62.69 -41.31 99.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.893 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.04 -44.89 79.06 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.018 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.637 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.91 -43.01 94.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.03 -24.56 66.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 0.0 110.952 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 -28.49 46.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.565 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.422 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -86.99 -20.14 27.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.884 -178.074 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -92.59 149.75 21.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.498 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 pttp -105.73 135.41 47.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.422 0.63 . . . . 0.0 111.051 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.432 HG23 HD12 ' A' ' 23' ' ' ILE . 3.5 mp -110.09 130.84 22.4 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.288 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -84.67 164.47 12.2 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.143 1.895 . . . . 0.0 112.21 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 ttmm -70.88 126.87 92.19 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.933 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.488 ' HB2' ' HB2' ' A' ' 88' ' ' TYR . 52.4 Cg_exo -54.66 117.73 4.31 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.947 2.432 . . . . 0.0 112.048 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -70.31 -62.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.571 2.181 . . . . 0.0 112.832 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.65 138.81 32.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.748 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.516 ' HA ' ' HB3' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -61.05 -30.79 70.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 0.0 111.046 -178.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.09 -52.76 63.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 177.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -69.12 -35.51 68.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.046 0.45 . . . . 0.0 110.404 178.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.516 ' HB3' ' HA ' ' A' ' 85' ' ' GLN . 0.9 OUTLIER -56.39 -43.87 79.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.873 179.682 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 33.7 mt-10 -75.61 -35.01 60.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.171 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.3 t -64.98 -43.16 96.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.106 0.479 . . . . 0.0 109.885 178.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -83.69 41.83 0.81 Allowed 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.077 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 1.1 tpmp? -101.82 -23.98 14.11 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.121 0.486 . . . . 0.0 109.738 175.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -158.98 59.89 0.42 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.052 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.12 95.78 49.16 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.595 -176.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.691 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.1 Cg_exo -72.96 137.72 27.18 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 123.012 2.474 . . . . 0.0 111.511 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.38 153.66 17.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.331 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.77 133.49 40.69 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.191 173.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.439 ' CZ ' HG21 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -131.82 103.06 6.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.519 0.676 . . . . 0.0 111.25 179.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.625 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.3 OUTLIER -139.95 167.6 17.78 Favored Pre-proline 0 C--N 1.315 -0.912 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.389 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.625 ' HD2' ' HB2' ' A' ' 99' ' ' LYS . 9.5 Cg_endo -45.45 107.03 0.1 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.059 2.506 . . . . 0.0 110.626 175.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.872 ' HB2' ' HA ' ' A' ' 35' ' ' SER . 4.2 m-70 -62.5 130.62 45.98 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 113.99 -1.459 . . . . 0.0 113.298 -163.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.954 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.196 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.777 0.322 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.406 ' HB3' ' H ' ' A' ' 3' ' ' PHE . 3.7 tm-20 -127.19 -83.27 0.61 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.327 -179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.406 ' H ' ' HB3' ' A' ' 2' ' ' GLU . 5.4 m-85 62.74 15.04 7.78 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.627 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 68.37 5.25 41.82 Favored Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 116.258 -0.428 . . . . 0.0 113.303 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.97 -47.33 0.66 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.614 0.766 . . . . 0.0 111.556 -177.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.43 -1.0 57.3 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.567 0.222 . . . . 0.0 111.306 -178.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp 71.46 -63.05 0.44 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.666 0.786 . . . . 0.0 111.235 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -154.67 -52.11 0.09 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.0 t30 67.15 -67.95 0.16 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.436 0.695 . . . . 0.0 112.171 176.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.89 64.59 3.2 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.392 -0.683 . . . . 0.0 111.392 -177.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.72 105.18 12.12 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.857 0.36 . . . . 0.0 111.179 -176.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.12 -20.89 18.28 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.04 0.448 . . . . 0.0 109.931 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 66.07 48.61 63.87 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.278 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.84 68.82 0.66 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.45 0.643 . . . . 0.0 110.739 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -167.22 -49.08 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.225 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.478 ' HA ' HG23 ' A' ' 87' ' ' VAL . 0.7 OUTLIER -87.05 -40.69 14.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.835 176.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.6 p-10 -60.5 -26.73 67.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.864 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.32 -52.53 53.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.654 0.264 . . . . 0.0 110.56 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.559 ' CE2' HD11 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -64.03 -37.98 89.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.583 178.109 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . -64.28 -39.85 94.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.233 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.52 -33.46 87.31 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.733 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.89 -38.77 86.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.587 0.232 . . . . 0.0 111.214 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.559 HD11 ' CE2' ' A' ' 19' ' ' TYR . 5.8 mt -62.51 -36.03 72.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.003 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.519 ' HB3' ' NE2' ' A' ' 101' ' ' HIS . 3.6 mmtp -58.46 -50.18 74.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.147 -178.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.51 -32.74 58.47 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.539 -178.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.489 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.89 -47.94 83.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.14 0.495 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.419 HG23 ' CB ' ' A' ' 73' ' ' ALA . 84.1 mt -73.92 -31.39 30.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.804 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -29.38 70.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.912 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.97 -8.54 59.0 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.987 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.49 36.34 4.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.79 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.567 ' HB2' ' H ' ' A' ' 35' ' ' SER . 14.0 p90 -72.53 123.53 23.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.482 0.658 . . . . 0.0 110.956 -178.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.447 ' HB3' ' H ' ' A' ' 33' ' ' ASP . 0.9 OUTLIER -74.43 -77.08 0.12 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 174.43 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.447 ' H ' ' HB3' ' A' ' 32' ' ' TYR . 0.5 OUTLIER -128.7 26.33 5.6 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.455 -1.702 . . . . 0.0 107.101 166.374 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.443 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . . . -69.96 -56.29 7.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 113.841 -1.527 . . . . 0.0 111.283 -173.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.567 ' H ' ' HB2' ' A' ' 31' ' ' PHE . 16.3 m -69.23 -16.73 63.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.163 0.506 . . . . 0.0 110.679 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 m -97.0 -11.94 23.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.764 -172.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.607 ' O ' ' HG2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -83.15 43.48 0.87 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -174.855 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.8 67.38 0.1 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.473 0.654 . . . . 0.0 112.471 -175.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -172.39 1.04 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.674 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.149 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 mmtp -138.64 163.56 31.76 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.849 0.357 . . . . 0.0 111.196 -177.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.39 162.37 22.9 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.205 175.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.71 107.1 1.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.712 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.2 m -87.59 135.01 33.53 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.786 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -127.0 126.73 43.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.82 0.343 . . . . 0.0 110.692 -179.033 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.784 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 2.7 ttm-85 -80.61 97.92 7.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.715 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 46' ' ' ILE . 1.6 pt -105.91 149.07 9.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.33 0.586 . . . . 0.0 111.528 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.573 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 22.1 mttp -127.1 109.4 11.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.932 177.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -95.39 150.14 20.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.395 0.617 . . . . 0.0 111.694 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.512 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -111.58 161.06 27.14 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.366 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.493 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.1 Cg_endo -60.05 -17.07 43.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.23 2.62 . . . . 0.0 113.169 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.9 0.43 51.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.791 0.329 . . . . 0.0 111.125 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.62 29.54 52.02 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.869 177.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -132.88 143.98 49.87 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.446 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -89.49 112.48 23.66 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.846 0.355 . . . . 0.0 110.352 -178.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.512 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.0 OUTLIER -74.4 -30.87 62.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.224 -179.532 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.573 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.8 t70 -133.32 139.52 46.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.176 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.428 HG12 HD22 ' A' ' 71' ' ' LEU . 5.6 tt -155.78 106.78 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.293 0.568 . . . . 0.0 109.652 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -124.03 133.75 24.89 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.133 -172.492 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 24.7 Cg_exo -60.47 125.52 17.59 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.461 2.107 . . . . 0.0 111.613 177.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' ' HB2' ' A' ' 45' ' ' ARG . 9.4 mm-40 -87.66 -68.57 0.75 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.703 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.75 133.74 4.31 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.272 -0.877 . . . . 0.0 111.291 176.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 154.45 -159.16 28.71 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.176 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 66' ' ' LEU . 12.0 t70 -78.18 125.87 84.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.469 0.176 . . . . 0.0 110.76 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 53.3 Cg_exo -53.6 -37.32 83.09 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.923 2.415 . . . . 0.0 112.82 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.09 -43.58 42.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.213 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.406 ' HB3' ' HB3' ' A' ' 63' ' ' ASP . 37.1 tp -65.99 -47.09 75.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.884 0.373 . . . . 0.0 110.388 179.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.577 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 13.3 m -62.58 -44.63 95.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.909 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.492 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -61.16 -41.51 96.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.907 178.401 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.53 -31.56 72.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.022 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.83 -44.93 68.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 0.1 OUTLIER -62.31 -41.92 98.94 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.836 0.35 . . . . 0.0 110.576 178.696 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -46.57 87.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.957 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.419 ' CB ' HG23 ' A' ' 27' ' ' ILE . . . -65.15 -43.43 91.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.545 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.36 75.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.36 -26.08 55.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.712 178.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.05 -33.14 33.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.409 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.489 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -81.93 166.95 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.028 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.22 115.39 26.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.1 178.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 28.5 mm -87.31 125.63 65.14 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.959 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.55 124.86 17.28 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.414 2.076 . . . . 0.0 111.715 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.524 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -55.86 145.48 52.57 Favored Pre-proline 0 N--CA 1.447 -0.613 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.665 -178.386 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.43 ' HG3' ' HZ ' ' A' ' 91' ' ' PHE . 12.4 Cg_exo -34.64 99.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 125.129 3.886 . . . . 0.0 114.774 -175.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -79.07 -37.52 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.529 2.153 . . . . 0.0 111.251 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.503 ' O ' HG12 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -99.42 146.69 26.05 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.012 177.235 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -76.83 -40.08 49.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 111.074 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.9 -27.59 64.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.924 0.393 . . . . 0.0 111.249 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.503 HG12 ' O ' ' A' ' 84' ' ' SER . 0.5 OUTLIER -71.0 -23.7 23.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.618 -178.208 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.519 ' HA ' ' CZ ' ' A' ' 91' ' ' PHE . 89.6 t80 -65.4 -34.03 77.35 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.103 0.477 . . . . 0.0 110.467 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -74.53 -18.35 60.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.563 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 52.5 t -85.93 -53.4 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.938 -177.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.519 ' CZ ' ' HA ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -81.25 9.87 6.36 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -173.182 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -61.61 -30.18 70.52 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.573 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 10.8 t30 -160.09 72.53 0.5 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.529 -1.214 . . . . 0.0 108.643 171.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.425 ' CB ' ' HA ' ' A' ' 91' ' ' PHE . . . -113.17 84.58 7.38 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.943 -175.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.784 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 21.2 Cg_exo -73.46 110.78 3.14 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.065 2.51 . . . . 0.0 111.71 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.63 151.7 19.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.823 -175.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.712 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 29.2 t70 -103.76 100.94 10.77 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 176.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -86.53 135.06 33.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.227 0.536 . . . . 0.0 111.251 -176.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.26 144.01 49.17 Favored Pre-proline 0 C--N 1.323 -0.584 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.701 178.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.607 ' HG2' ' O ' ' A' ' 37' ' ' TYR . 91.4 Cg_exo -46.03 100.07 0.04 OUTLIER 'Trans proline' 0 N--CA 1.475 0.419 0 C-N-CA 124.061 3.174 . . . . 0.0 112.061 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.519 ' NE2' ' HB3' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -63.14 135.25 57.06 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -167.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 . . . . . 0 C--N 1.317 -0.808 0 CA-C-N 113.785 -1.552 . . . . 0.0 107.637 169.728 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 120.937 0.398 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -143.64 96.93 2.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.596 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -100.56 86.76 3.21 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.932 0.396 . . . . 0.0 111.276 -175.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.66 76.83 2.06 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 174.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -59.81 116.24 3.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.732 0.301 . . . . 0.0 111.289 -174.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -51.91 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.132 -178.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.24 152.96 18.85 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.14 177.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -87.76 130.28 34.9 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 175.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.47 ' HB3' ' H ' ' A' ' 10' ' ' GLY . 4.6 t-20 -83.56 -101.19 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.419 -173.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.47 ' H ' ' HB3' ' A' ' 9' ' ' ASN . . . 79.1 -70.42 2.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.779 -0.725 . . . . 0.0 111.507 -175.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -167.96 -98.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.605 0.362 . . . . 0.0 110.154 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.8 -34.42 30.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.125 0.488 . . . . 0.0 110.717 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 80.12 -60.37 4.47 Favored Glycine 0 CA--C 1.519 0.295 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.962 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.6 -53.11 25.8 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -57.35 -42.96 83.01 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.99 0.424 . . . . 0.0 111.494 -177.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.493 ' H ' HG13 ' A' ' 16' ' ' ILE . 0.8 OUTLIER -74.01 -42.08 52.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.234 -178.783 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -36.91 85.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.076 0.465 . . . . 0.0 110.554 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -69.91 -37.96 76.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.336 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -42.61 99.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.672 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.42 82.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 0.0 111.111 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.26 -33.79 56.04 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.815 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.73 -28.29 69.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.693 0.283 . . . . 0.0 111.432 -176.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.469 ' O ' HG13 ' A' ' 27' ' ' ILE . 4.0 mt -70.76 -35.5 60.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.71 0.291 . . . . 0.0 110.485 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -59.87 -47.62 85.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.74 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.7 -35.54 75.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.886 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.67 -47.71 81.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.397 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 23' ' ' ILE . 53.6 mt -64.59 -36.72 78.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.943 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -64.2 -38.57 91.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.0 110.962 176.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.1 m -73.15 -10.42 59.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.164 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.749 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.23 -8.79 15.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.2 -178.608 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.61 ' HB3' ' O ' ' A' ' 33' ' ' ASP . 0.2 OUTLIER -66.27 132.29 48.07 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 176.721 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -57.62 -56.99 14.8 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 -175.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.857 ' HB3' ' HA ' ' A' ' 36' ' ' SER . 33.3 t70 -91.35 151.4 20.87 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 165.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -47.27 -58.85 3.64 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.198 0.454 . . . . 0.0 111.282 -172.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.727 ' HB3' ' HB2' ' A' ' 102' ' ' HIS . 0.1 OUTLIER -84.44 -37.57 21.25 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.96 170.68 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.857 ' HA ' ' HB3' ' A' ' 33' ' ' ASP . 49.5 m 74.58 -47.39 0.63 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.096 -173.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.481 ' O ' ' HB2' ' A' ' 35' ' ' SER . 9.5 m-85 -138.23 -165.28 1.77 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 176.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.677 ' HA ' ' HG2' ' A' ' 100' ' ' PRO . . . -173.11 169.28 4.64 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.812 175.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.76 36.28 93.1 Favored Glycine 0 N--CA 1.452 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.869 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -144.46 151.06 38.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.856 0.36 . . . . 0.0 111.026 -177.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -127.3 128.35 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.642 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.21 105.25 6.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.093 0.473 . . . . 0.0 111.473 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -89.27 118.25 28.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.435 -179.362 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.61 127.37 54.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.36 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.82 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 1.1 tpp180 -80.1 111.89 16.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.9 pt -120.97 137.58 54.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.285 0.564 . . . . 0.0 110.771 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -122.93 111.07 16.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.354 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.6 tp -94.95 143.67 26.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.17 0.51 . . . . 0.0 111.701 -174.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.633 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -103.39 166.67 11.37 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.542 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.633 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 36.2 Cg_endo -64.17 -11.51 28.04 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.168 1.912 . . . . 0.0 111.782 177.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 81' ' ' LYS . 24.5 t70 -85.52 -13.38 49.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.309 176.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.03 -15.39 63.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.349 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.53 149.16 36.73 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.975 0.417 . . . . 0.0 110.607 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.26 105.55 17.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.887 178.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.424 HD21 ' HB2' ' A' ' 49' ' ' ALA . 0.2 OUTLIER -68.25 -30.63 69.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.277 0.561 . . . . 0.0 109.85 179.204 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -135.24 131.45 36.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.65 176.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -156.49 105.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.172 0.511 . . . . 0.0 109.656 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 7.0 ptpp? -154.77 148.18 18.48 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.906 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.66 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 10.4 Cg_exo -73.0 129.61 14.44 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.032 2.488 . . . . 0.0 111.663 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.36 -70.56 0.72 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.9 127.34 6.96 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.674 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 164.45 -138.8 5.47 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.592 -179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.535 ' HB3' ' HB2' ' A' ' 66' ' ' LEU . 11.5 t70 -122.78 129.97 24.81 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 53.6 Cg_exo -55.76 -34.4 90.85 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.131 2.554 . . . . 0.0 113.68 -176.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.77 -43.3 18.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.751 0.31 . . . . 0.0 110.76 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.681 HD11 ' HD3' ' A' ' 100' ' ' PRO . 0.2 OUTLIER -58.82 -52.25 66.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.569 178.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.66 ' SG ' ' HB3' ' A' ' 59' ' ' PRO . 11.9 m -63.06 -36.76 84.65 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.846 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 4.7 tp60 -63.53 -43.24 97.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.72 0.295 . . . . 0.0 110.787 177.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.12 99.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.069 0.461 . . . . 0.0 110.221 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.86 95.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.048 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 66.9 mt -57.56 -49.55 76.02 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.835 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.45 -41.62 94.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.168 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.62 69.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.263 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.03 75.07 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.842 0.353 . . . . 0.0 111.142 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -68.21 -23.85 64.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.176 0.512 . . . . 0.0 110.891 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.749 ' HB3' ' HG2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -103.54 3.32 34.59 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.57 179.468 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.45 146.28 45.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.182 -177.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.79 86.25 7.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.87 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.3 109.02 62.73 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.926 177.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -72.1 159.88 48.83 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.983 2.455 . . . . 0.0 112.762 -174.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 51' ' ' ASP . 2.3 ttmt -69.75 117.55 54.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.499 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 81' ' ' LYS . 32.6 Cg_exo -65.48 109.76 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.764 2.31 . . . . 0.0 112.81 -175.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -82.72 -40.44 0.12 Allowed 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.468 2.112 . . . . 0.0 111.852 178.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.3 120.37 20.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.309 177.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -65.12 -31.9 73.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.924 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.43 79.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.006 0.432 . . . . 0.0 110.643 176.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.402 ' HA ' HG23 ' A' ' 16' ' ' ILE . 28.6 t -68.48 -48.98 69.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.544 177.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -37.65 83.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 -179.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.9 mm-40 -71.67 -33.08 68.54 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.622 -178.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.25 -38.0 40.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.193 0.52 . . . . 0.0 110.132 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -79.47 13.7 1.89 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.596 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -70.43 -22.84 62.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.172 175.744 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -161.58 77.84 0.54 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.154 174.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -129.83 80.84 70.6 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.264 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.82 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.4 Cg_exo -73.18 141.24 32.15 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.747 2.298 . . . . 0.0 111.742 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.3 mt -97.96 129.43 44.86 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.291 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.509 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 31.8 t70 -97.85 95.21 7.37 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 172.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -104.32 139.49 39.23 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.492 0.663 . . . . 0.0 112.14 -169.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.38 150.1 48.92 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 114.466 -1.243 . . . . 0.0 107.808 171.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.681 ' HD3' HD11 ' A' ' 66' ' ' LEU . 14.5 Cg_endo -57.95 104.28 0.17 Allowed 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 121.915 1.743 . . . . 0.0 110.817 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.437 ' HD1' ' HA ' ' A' ' 101' ' ' HIS . 0.1 OUTLIER -53.38 111.58 0.73 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.766 -1.107 . . . . 0.0 113.493 -166.392 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.727 ' HB2' ' HB3' ' A' ' 35' ' ' SER . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-N 114.343 -1.299 . . . . 0.0 108.905 173.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.662 0.268 . . . . 0.0 110.483 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 2.4 pm0 -71.48 101.62 2.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.217 178.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.42 ' HD1' ' HA ' ' A' ' 3' ' ' PHE . 1.2 m-30 -88.99 -55.39 3.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.524 -177.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 63.98 -97.73 0.23 Allowed Glycine 0 C--N 1.332 0.327 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -177.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.435 ' HB3' ' H ' ' A' ' 6' ' ' THR . 13.7 t30 -151.66 -128.33 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 173.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.497 ' HB ' ' H ' ' A' ' 7' ' ' LYS . 0.2 OUTLIER 53.91 -97.42 0.07 Allowed 'General case' 0 C--O 1.237 0.417 0 C-N-CA 122.962 0.505 . . . . 0.0 112.104 175.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.497 ' H ' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER 74.09 -58.6 0.58 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.542 0.737 . . . . 0.0 110.913 -178.013 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.47 -173.94 3.95 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 57.45 51.89 9.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.173 0.511 . . . . 0.0 110.952 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -90.45 87.98 1.42 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.358 -178.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.74 119.91 37.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.675 0.274 . . . . 0.0 111.068 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.43 71.52 8.44 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.362 0.601 . . . . 0.0 110.38 178.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 169.46 -23.2 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.491 -177.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.07 134.6 49.3 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 123.574 0.22 . . . . 0.0 110.809 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 72.68 -47.93 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.762 0.825 . . . . 0.0 111.983 -178.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.438 ' H ' HG13 ' A' ' 16' ' ' ILE . 6.9 mt -59.72 -45.81 94.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.843 0.354 . . . . 0.0 110.972 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.88 -37.49 84.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.664 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -70.23 -47.23 62.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.751 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.465 ' CB ' HG21 ' A' ' 87' ' ' VAL . 5.3 t80 -58.44 -49.04 78.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.992 179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.28 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.259 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.81 -49.1 10.84 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.179 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -56.81 -39.28 73.89 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 122.72 0.408 . . . . 0.0 111.658 -177.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.497 HG12 HD12 ' A' ' 79' ' ' ILE . 76.0 mt -57.72 -43.8 84.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.995 0.426 . . . . 0.0 110.61 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.451 ' HA ' ' HZ ' ' A' ' 98' ' ' PHE . 31.8 mttp -65.09 -47.77 76.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.927 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.47 -39.35 79.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.392 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.493 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -66.53 -46.63 75.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.047 0.451 . . . . 0.0 110.677 178.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.45 HD12 ' CE2' ' A' ' 98' ' ' PHE . 1.7 mt -62.96 -50.27 80.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.287 -178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.508 ' HG3' ' HB3' ' A' ' 35' ' ' SER . 0.0 OUTLIER -64.13 -20.82 66.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.037 -176.659 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 60.1 m -67.45 -11.84 58.84 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.77 0.319 . . . . 0.0 111.049 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HE2' ' HA ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -113.17 9.81 18.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.265 0.555 . . . . 0.0 110.091 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.459 ' CG ' ' HB3' ' A' ' 34' ' ' ALA . 1.9 m-30 -113.24 144.61 42.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.479 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -115.4 -75.94 0.58 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.017 0.437 . . . . 0.0 110.312 177.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -96.13 0.42 51.29 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 121.827 0.822 . . . . 0.0 110.455 178.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' HB3' ' CG ' ' A' ' 31' ' ' PHE . . . -77.93 -36.08 49.79 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 114.017 -1.447 . . . . 0.0 110.3 174.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.508 ' HB3' ' HG3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -75.84 -18.01 59.62 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.792 176.764 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.6 m -97.61 45.61 1.03 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.323 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.438 ' HD2' HD13 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -135.64 37.65 2.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.953 -178.041 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.05 -14.2 33.67 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.655 -174.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.69 -17.03 76.31 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.075 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt -115.19 146.47 41.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.989 0.423 . . . . 0.0 110.398 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.28 168.7 11.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.602 179.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 4.7 t -152.89 57.64 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.049 0.452 . . . . 0.0 110.522 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.431 HG23 ' HA ' ' A' ' 97' ' ' ASP . 1.8 m -69.36 114.13 7.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.809 0.338 . . . . 0.0 110.219 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.2 mt -107.33 124.28 49.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.805 -176.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.576 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -77.63 97.32 5.06 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 174.567 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 95' ' ' PRO . 1.1 pt -121.41 145.54 27.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -174.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HD3' HD11 ' A' ' 55' ' ' LEU . 2.5 tttp -127.94 115.34 18.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.384 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.489 HD13 ' HD2' ' A' ' 91' ' ' PHE . 15.9 mt -94.54 125.02 38.92 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.741 -175.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.468 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -75.26 148.1 83.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.392 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.715 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 2.4 Cg_endo -48.87 -28.4 13.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.899 3.066 . . . . 0.0 113.621 -176.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.46 7.49 9.71 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.32 46.65 9.86 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.378 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.468 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.51 139.12 26.57 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.165 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.63 122.57 24.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.857 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.506 HD11 ' HD3' ' A' ' 47' ' ' LYS . 1.2 pp -93.81 -31.16 14.48 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -129.48 138.44 51.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.634 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.2 tt -159.15 106.9 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.232 0.539 . . . . 0.0 110.101 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -145.43 139.98 15.47 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.904 -175.331 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 14.9 Cg_exo -66.23 120.67 7.84 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.604 2.203 . . . . 0.0 111.196 176.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -102.53 -49.52 3.83 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.421 -175.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -145.9 111.2 0.57 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.278 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 160.3 -161.95 32.92 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.117 -1.04 . . . . 0.0 112.587 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 14.8 t70 -78.75 129.85 72.48 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 120.752 0.311 . . . . 0.0 110.689 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 63' ' ' ASP . 31.2 Cg_exo -62.25 -34.03 79.34 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.071 2.514 . . . . 0.0 112.929 -176.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -79.62 -41.76 26.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.92 0.391 . . . . 0.0 110.627 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.438 HD13 ' HD2' ' A' ' 37' ' ' TYR . 31.2 tp -59.21 -52.88 63.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.687 178.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 60.3 m -73.22 -15.13 61.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.716 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -72.68 -39.07 67.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.179 0.514 . . . . 0.0 109.873 174.283 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.86 62.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.379 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.402 ' HA ' ' HZ ' ' A' ' 31' ' ' PHE . . . -60.84 -38.01 84.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.198 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 3.0 mt -61.92 -41.41 97.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.139 0.495 . . . . 0.0 110.278 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.71 71.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.809 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.97 91.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.47 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.66 -30.45 71.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.869 0.366 . . . . 0.0 111.343 -178.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -32.79 58.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.352 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -31.69 36.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.681 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.493 ' HB1' ' HB1' ' A' ' 26' ' ' ALA . . . -70.74 157.61 37.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.981 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.29 94.14 4.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.605 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.497 HD12 HG12 ' A' ' 23' ' ' ILE . 33.1 mm -76.33 122.09 86.11 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.803 177.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.7 153.79 76.62 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.681 2.254 . . . . 0.0 111.675 -177.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.619 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 0.9 OUTLIER -74.53 147.0 84.43 Favored Pre-proline 0 C--N 1.324 -0.536 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 175.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.619 ' HD2' ' HG2' ' A' ' 81' ' ' LYS . 10.6 Cg_endo -52.96 117.03 3.32 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.928 2.419 . . . . 0.0 111.955 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.465 ' HD2' HG11 ' A' ' 87' ' ' VAL . 5.8 Cg_endo -78.67 -64.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.236 1.958 . . . . 0.0 112.404 -177.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 48.2 m -95.49 159.94 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.153 0.501 . . . . 0.0 111.133 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -65.9 -27.91 68.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.667 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -61.35 -50.78 71.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.575 -177.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.465 HG11 ' HD2' ' A' ' 83' ' ' PRO . 4.1 p -74.76 -22.66 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.288 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -62.04 -35.95 80.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.289 0.566 . . . . 0.0 110.657 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.648 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.65 -18.0 55.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.138 -178.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.06 -53.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.927 -177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.715 ' HZ ' ' HA ' ' A' ' 50' ' ' PRO . 0.5 OUTLIER -61.82 -19.03 62.11 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -171.184 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.648 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 8.8 ptpt -73.22 -6.54 46.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.59 -178.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -162.19 50.92 0.2 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.967 0.413 . . . . 0.0 111.15 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -132.84 105.49 12.74 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.228 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.576 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 3.0 Cg_exo -73.77 139.9 28.41 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.707 2.271 . . . . 0.0 110.923 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.56 127.53 35.89 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.066 0.46 . . . . 0.0 111.366 -175.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.431 ' HA ' HG23 ' A' ' 43' ' ' THR . 46.6 t0 -93.07 94.35 8.81 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 173.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.552 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 0.3 OUTLIER -88.18 137.75 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.652 -171.658 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -137.73 112.51 9.06 Favored Pre-proline 0 C--N 1.319 -0.752 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.8 174.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -45.56 127.73 9.88 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 123.608 2.872 . . . . 0.0 113.752 -173.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.482 ' HB2' ' CD ' ' A' ' 28' ' ' GLU . 1.8 m80 -75.93 79.56 2.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.178 -0.919 . . . . 0.0 112.121 -175.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.165 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.871 173.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -106.65 -57.5 2.05 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 69.25 -57.95 0.52 Allowed 'General case' 0 N--CA 1.471 0.607 0 O-C-N 124.072 0.858 . . . . 0.0 111.332 179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.431 ' H ' ' H ' ' A' ' 5' ' ' ASN . . . 165.03 0.31 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -178.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.431 ' H ' ' H ' ' A' ' 4' ' ' GLY . 5.3 m120 64.45 19.05 11.66 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.299 0.639 . . . . 0.0 110.809 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.87 72.03 8.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.859 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.1 tttt -139.39 138.2 36.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.012 -177.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -81.26 74.65 8.25 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.49 166.13 10.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.71 -174.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.0 -142.66 15.52 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.643 -176.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 15' ' ' ASP . . . -140.16 96.48 3.06 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.649 0.261 . . . . 0.0 110.722 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.06 -21.97 60.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.399 179.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.01 135.83 23.34 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 173.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 76.39 -32.39 0.2 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.56 0.744 . . . . 0.0 111.08 -173.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 11.2 t0 -61.37 -50.85 71.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.898 0.38 . . . . 0.0 110.364 176.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.564 HG12 HG22 ' A' ' 87' ' ' VAL . 22.9 mt -65.28 -41.07 90.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.688 177.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -59.41 -45.08 92.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.778 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -67.38 -48.57 67.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.938 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.545 ' HD2' ' HG2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -60.52 -34.78 74.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.624 -176.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.5 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.99 -40.54 96.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.961 0.41 . . . . 0.0 110.995 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.34 -29.22 62.43 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.891 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -62.67 -37.22 85.55 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 122.148 0.179 . . . . 0.0 111.008 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.5 HD12 ' HA ' ' A' ' 20' ' ' ALA . 12.8 mt -58.39 -44.8 89.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.022 0.439 . . . . 0.0 110.717 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -64.3 -45.42 88.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.084 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -72.45 -31.12 65.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.428 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.39 -45.95 83.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.038 0.447 . . . . 0.0 111.081 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.498 HG23 ' HB1' ' A' ' 73' ' ' ALA . 57.9 mt -60.84 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.123 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.486 ' HG2' ' HA ' ' A' ' 32' ' ' TYR . 2.1 tt0 -74.25 -21.29 59.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.563 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.8 m -67.53 -17.23 64.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.055 0.455 . . . . 0.0 109.816 175.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.7 -47.97 4.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.496 172.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.443 ' CA ' ' HB3' ' A' ' 34' ' ' ALA . 3.8 m-30 -107.53 84.52 1.98 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.512 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.486 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -68.29 -90.77 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.874 0.368 . . . . 0.0 111.455 -176.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.451 ' H ' ' HB3' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -80.39 6.06 13.23 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 122.455 1.122 . . . . 0.0 109.496 174.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.443 ' HB3' ' CA ' ' A' ' 31' ' ' PHE . . . -76.03 -31.86 59.08 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 112.937 -1.938 . . . . 0.0 109.988 170.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.442 ' O ' ' HB3' ' A' ' 100' ' ' PRO . 60.4 m -77.51 -18.08 57.37 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.16 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 33' ' ' ASP . 0.5 OUTLIER -68.09 95.58 0.57 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.38 179.024 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -123.26 -68.51 0.87 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.397 -174.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.448 ' HB3' ' HG2' ' A' ' 40' ' ' LYS . . . -174.8 -160.15 0.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.708 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -94.03 51.78 2.22 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 172.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.448 ' HG2' ' HB3' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -93.92 166.41 12.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.19 0.519 . . . . 0.0 111.684 -174.052 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.3 152.07 36.47 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.829 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.504 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -163.56 90.33 0.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.156 0.503 . . . . 0.0 110.937 -179.601 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.762 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -70.87 116.88 11.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.409 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.2 mt -99.06 118.13 35.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.712 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 5.2 ttt180 -80.53 101.14 8.95 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -120.26 137.24 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.36 0.6 . . . . 0.0 111.588 -175.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.631 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -129.8 109.23 10.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.107 -0.952 . . . . 0.0 108.605 174.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.51 144.07 36.65 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.529 0.681 . . . . 0.0 111.627 -173.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -100.48 161.5 23.8 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.577 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.652 ' HG3' ' HB2' ' A' ' 88' ' ' TYR . 36.4 Cg_exo -57.45 -14.19 15.62 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.041 2.494 . . . . 0.0 112.699 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.22 -11.89 59.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.107 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.2 34.64 23.06 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.886 -179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.47 144.44 47.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.787 0.327 . . . . 0.0 110.238 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.489 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -100.09 97.21 8.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.8 178.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -29.8 63.62 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.438 -177.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -129.07 127.09 40.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.319 176.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.64 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 1.0 OUTLIER -159.08 108.77 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.339 -175.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -158.0 151.38 18.95 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -72.45 119.81 6.35 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.926 2.417 . . . . 0.0 111.963 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.762 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 74.3 mt-10 -82.37 -65.06 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.143 0.496 . . . . 0.0 109.766 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -143.77 123.6 2.08 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.384 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.504 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 173.84 -178.02 45.89 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.375 -0.917 . . . . 0.0 112.795 -178.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.34 129.63 90.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.37 -47.82 25.3 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.939 2.426 . . . . 0.0 112.649 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.26 -46.88 75.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.192 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.96 -55.31 36.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.122 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.657 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 5.8 m -63.3 -31.74 72.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.045 -177.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -63.83 -46.34 85.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.77 0.319 . . . . 0.0 110.592 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.19 -34.2 74.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.534 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.3 78.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.227 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 51.8 mt -59.96 -44.43 94.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.101 0.477 . . . . 0.0 110.56 178.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.75 73.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.827 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.11 -45.34 89.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.75 -178.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.14 -35.34 80.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.906 0.384 . . . . 0.0 111.155 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -68.57 -32.84 73.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.545 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.3 mp -80.48 -32.04 37.16 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.856 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.11 130.37 43.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.659 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -88.38 84.68 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.503 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.423 HG21 ' HE2' ' A' ' 91' ' ' PHE . 3.0 mt -70.84 132.18 87.07 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.602 -179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.545 ' HG2' ' HD2' ' A' ' 19' ' ' TYR . 18.9 Cg_endo -61.83 125.26 16.19 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.747 2.298 . . . . 0.0 112.083 -178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.5 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -75.33 132.39 76.19 Favored Pre-proline 0 N--CA 1.443 -0.798 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.417 -178.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 60.7 Cg_exo -52.92 115.71 2.44 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.959 2.44 . . . . 0.0 112.712 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 82' ' ' PRO . 4.6 Cg_endo -81.14 -69.51 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.95 2.434 . . . . 0.0 111.214 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.67 146.65 49.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.596 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.23 -26.76 68.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.855 0.36 . . . . 0.0 111.446 -175.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.07 -27.44 69.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.108 178.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.564 HG22 HG12 ' A' ' 16' ' ' ILE . 13.6 t -77.26 -32.2 18.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.951 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.652 ' HB2' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -61.92 -35.5 78.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.06 0.457 . . . . 0.0 110.225 178.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.517 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -67.74 -27.17 66.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.171 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.3 t -68.24 -57.32 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.442 ' HD1' ' HB3' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -85.5 3.35 40.79 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -176.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.517 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -63.82 -23.94 67.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.915 0.388 . . . . 0.0 110.411 178.469 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -163.62 78.22 0.41 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.749 174.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.442 ' HB3' ' HD1' ' A' ' 91' ' ' PHE . . . -135.47 84.25 34.96 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.144 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.712 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 4.3 Cg_exo -74.4 104.68 1.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.786 2.324 . . . . 0.0 110.629 177.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.82 140.67 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.21 -174.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 4.8 t70 -87.45 112.35 22.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.845 177.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -86.81 111.37 20.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.076 0.465 . . . . 0.0 110.595 -177.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 100' ' ' PRO . 4.6 mtmm -105.02 138.58 19.55 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.555 176.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.442 ' HB3' ' O ' ' A' ' 35' ' ' SER . 76.3 Cg_exo -53.23 109.45 0.36 Allowed 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.338 2.692 . . . . 0.0 112.951 -177.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -61.39 143.18 56.25 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.928 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.926 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.863 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.604 0.24 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 3' ' ' PHE . 0.0 OUTLIER -70.14 -54.52 12.57 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 2.0 m-85 74.6 -47.14 0.62 Allowed 'General case' 0 N--CA 1.472 0.644 0 O-C-N 124.034 0.834 . . . . 0.0 111.209 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 158.09 -149.76 20.27 Favored Glycine 0 N--CA 1.438 -1.225 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 -175.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -138.52 136.73 36.4 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 117.679 0.74 . . . . 0.0 110.84 175.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.04 108.21 18.15 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.94 151.33 39.09 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.993 0.425 . . . . 0.0 110.668 -178.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -151.6 132.3 14.02 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.104 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -142.9 17.43 1.96 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.968 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.99 -101.64 0.9 Allowed Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.396 -176.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.95 115.54 4.49 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 175.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -69.46 0.28 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.39 -178.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 145.32 -89.77 0.16 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 119.996 -1.097 . . . . 0.0 113.609 174.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.24 -41.05 71.63 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -173.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -50.52 73.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.648 0.261 . . . . 0.0 111.228 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.431 ' HA ' ' HD2' ' A' ' 19' ' ' TYR . 7.9 mt -62.78 -44.87 99.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.985 -179.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -66.07 -32.83 74.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.962 0.41 . . . . 0.0 110.853 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -69.65 -50.22 46.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.681 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.431 ' HD2' ' HA ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -62.87 -34.63 77.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.008 -178.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.55 87.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.062 0.458 . . . . 0.0 110.246 175.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.54 -33.02 75.73 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.234 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -60.69 -36.02 77.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.867 0.365 . . . . 0.0 110.78 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.453 HD12 HG23 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -62.61 -40.72 89.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.41 0.624 . . . . 0.0 109.404 177.837 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 13.1 mttt -66.06 -48.06 72.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.298 178.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 m -54.22 -36.73 63.8 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.798 0.332 . . . . 0.0 111.6 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.85 86.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.011 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -77.18 -42.11 31.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.439 -177.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 59.2 mt-10 -55.33 -38.62 68.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.677 -177.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.64 15.34 14.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.886 -176.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HD3' ' HB3' ' A' ' 76' ' ' LEU . 67.9 mttt -151.4 33.48 0.57 Allowed 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.788 ' HB2' ' H ' ' A' ' 35' ' ' SER . 21.8 p90 -58.59 -49.82 76.08 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 113.887 -1.506 . . . . 0.0 113.316 -167.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER 67.77 -70.1 0.13 Allowed 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.357 0.41 . . . . 0.0 110.334 -171.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -136.63 20.27 3.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.741 0.781 . . . . 0.0 110.424 175.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.65 ' O ' ' HB3' ' A' ' 100' ' ' PRO . . . -80.6 -56.97 3.8 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.681 177.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.788 ' H ' ' HB2' ' A' ' 31' ' ' PHE . 43.8 m -66.67 -16.67 64.37 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -174.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -20.46 61.14 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -170.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -127.45 64.52 1.34 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.587 ' HA ' ' HB2' ' A' ' 100' ' ' PRO . . . -70.5 121.77 18.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.067 172.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 132.58 -28.9 3.35 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -175.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.787 ' HB3' HD22 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -83.81 159.49 21.4 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 174.283 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.5 139.01 45.15 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.64 ' HB2' HD23 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -145.87 107.99 4.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.985 0.421 . . . . 0.0 111.151 -176.082 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 1.4 m -74.97 112.91 11.68 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.2 mt -103.69 122.48 45.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.934 177.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.568 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -78.63 102.95 8.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.888 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.64 HD11 ' HB2' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -101.29 110.33 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.279 -176.933 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.557 ' HB2' ' HB3' ' A' ' 56' ' ' ASP . 0.0 OUTLIER -101.98 98.39 8.61 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.93 177.814 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -100.04 131.24 46.12 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.269 0.557 . . . . 0.0 111.07 -174.419 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.406 ' HB3' ' HG2' ' A' ' 53' ' ' MET . . . -75.85 153.66 85.01 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.691 176.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.06 -27.01 34.6 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.186 2.591 . . . . 0.0 113.296 -178.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -77.35 -5.07 48.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.244 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.15 42.21 6.75 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.642 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.406 ' HG2' ' HB3' ' A' ' 49' ' ' ALA . 1.0 OUTLIER -127.82 149.39 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 177.753 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.477 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -81.43 105.64 12.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.39 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.454 ' HG ' ' HB3' ' A' ' 47' ' ' LYS . 1.5 pp -88.19 -24.28 23.34 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.504 -178.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 26.0 t0 -154.68 111.09 3.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.977 179.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.418 HD12 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -121.51 106.6 18.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.02 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -133.66 129.12 20.27 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -172.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 58' ' ' LYS . 12.6 Cg_exo -66.68 127.07 16.44 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.557 2.171 . . . . 0.0 110.919 175.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -90.28 -65.77 0.99 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.251 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.67 145.82 13.98 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.639 -0.791 . . . . 0.0 111.72 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 151.82 -136.16 5.35 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.866 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.51 119.21 59.41 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -53.53 -41.16 75.65 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.988 2.459 . . . . 0.0 113.064 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.67 -48.79 53.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.671 0.272 . . . . 0.0 110.933 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.787 HD22 ' HB3' ' A' ' 40' ' ' LYS . 7.8 tp -59.09 -46.39 88.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.699 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.5 m -61.4 -42.03 98.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.266 -177.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -40.2 94.96 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.723 0.296 . . . . 0.0 110.822 179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.05 -38.75 82.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.577 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.23 -36.53 82.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.023 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 45.3 mt -60.63 -45.1 95.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.696 177.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.1 -43.89 90.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.13 -48.71 77.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.115 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.5 -24.45 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.401 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -67.19 -38.13 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.012 0.434 . . . . 0.0 110.426 178.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.514 ' HA ' HD13 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -91.69 -17.75 24.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.707 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.27 138.17 58.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.189 -177.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.498 ' HD2' ' HA ' ' A' ' 78' ' ' LYS . 0.4 OUTLIER -82.25 86.36 6.67 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.005 178.638 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.453 HG23 HD12 ' A' ' 23' ' ' ILE . 30.5 mm -82.61 121.02 77.74 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.865 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -82.07 146.78 14.52 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.485 2.124 . . . . 0.0 112.219 -176.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.456 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -61.64 147.91 87.8 Favored Pre-proline 0 N--CA 1.446 -0.655 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.418 178.597 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -42.93 112.64 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.653 2.902 . . . . 0.0 113.524 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.53 -26.97 13.48 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.701 2.267 . . . . 0.0 112.284 -177.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.8 152.62 38.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.107 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -63.38 -34.98 78.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.862 -176.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.58 67.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.065 0.46 . . . . 0.0 110.77 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 88.1 t -68.37 -32.2 54.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.096 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.415 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -59.77 -42.11 92.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.986 179.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.42 ' H ' ' HG2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -79.81 -39.1 31.51 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.044 -0.262 . . . . 0.0 111.488 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.2 t -70.22 -46.46 71.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CD2' HD22 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -63.54 -13.95 46.42 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -176.586 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 18.1 mtmt -69.13 -5.83 24.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.861 0.362 . . . . 0.0 110.695 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -169.2 69.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -127.51 84.37 63.56 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.529 -174.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.568 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 11.5 Cg_exo -74.24 105.8 2.1 Favored 'Trans proline' 0 CA--C 1.53 0.322 0 C-N-CA 123.158 2.572 . . . . 0.0 111.8 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.64 ' HB2' HD11 ' A' ' 46' ' ' ILE . 2.7 mp -89.57 150.67 22.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.997 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.459 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 1.7 t0 -92.59 97.26 10.7 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -68.37 128.16 35.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.197 0.522 . . . . 0.0 111.418 -175.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.84 112.02 18.79 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.345 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.65 ' HB3' ' O ' ' A' ' 34' ' ' ALA . 51.1 Cg_exo -56.5 138.74 85.5 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 123.141 2.56 . . . . 0.0 111.89 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -88.9 154.17 20.46 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.021 -175.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 38' ' ' ALA . 7.8 t-80 . . . . . 0 C--O 1.246 0.915 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.48 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 120.733 0.301 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -111.33 155.3 23.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.423 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -109.96 -42.6 4.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 174.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 71.91 -134.01 21.4 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.696 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.52 67.12 1.15 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -46.69 85.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.139 -175.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.2 tttt 55.52 63.28 2.12 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.541 0.526 . . . . 0.0 110.621 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -59.38 121.6 11.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.477 -179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -146.36 -88.14 0.1 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.239 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.89 139.03 4.43 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.524 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.629 ' H ' HG22 ' A' ' 90' ' ' VAL . . . -93.07 163.77 13.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.673 0.273 . . . . 0.0 111.097 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.53 -48.85 24.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.105 -177.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.441 ' HA2' ' HB ' ' A' ' 16' ' ' ILE . . . 167.07 -99.2 0.15 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.427 -0.892 . . . . 0.0 112.677 179.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 62.42 -89.85 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.967 0.507 . . . . 0.0 111.475 -177.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -76.16 -16.81 59.79 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.334 0.588 . . . . 0.0 110.81 178.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.441 ' HB ' ' HA2' ' A' ' 13' ' ' GLY . 49.5 mm -69.13 -26.36 31.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.115 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -57.64 -47.1 83.17 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -65.17 -44.81 87.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.715 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -44.43 96.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.701 178.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.53 95.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.806 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.49 -43.87 97.51 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.981 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.493 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -66.79 -38.52 86.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.535 0.207 . . . . 0.0 111.04 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.493 ' N ' ' HG3' ' A' ' 22' ' ' GLN . 63.6 mt -65.32 -48.55 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.866 0.365 . . . . 0.0 110.576 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -63.37 -24.93 68.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.142 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 m -78.77 -45.43 21.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.439 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.96 -40.81 73.77 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.238 0.542 . . . . 0.0 110.879 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.631 HG23 ' HB3' ' A' ' 73' ' ' ALA . 5.8 mt -61.69 -46.18 97.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.56 -21.13 63.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.522 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -68.59 -11.76 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.873 0.368 . . . . 0.0 110.664 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.46 ' HG2' ' HB3' ' A' ' 76' ' ' LEU . 3.1 mptp? -103.41 -47.07 4.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.028 176.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.758 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 4.6 m-85 -104.97 69.7 0.88 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.157 176.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.459 ' C ' ' H ' ' A' ' 34' ' ' ALA . 1.1 p90 -55.07 117.07 3.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.881 -175.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 t0 64.01 -1.25 0.7 Allowed 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 115.025 -0.989 . . . . 0.0 112.763 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.758 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -81.67 -47.85 12.46 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.089 173.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.78 -22.81 49.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.456 178.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.78 84.81 7.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.508 -175.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.71 ' HB2' HD13 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -96.38 -144.17 0.28 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.042 175.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.791 ' HA ' ' HG3' ' A' ' 100' ' ' PRO . . . -161.87 144.02 11.47 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.561 -0.163 . . . . 0.0 110.561 177.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.11 46.45 92.67 Favored Glycine 0 C--N 1.332 0.31 0 O-C-N 123.535 0.522 . . . . 0.0 113.097 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.685 ' HB3' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -148.25 137.1 21.76 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.4 m -121.06 107.69 12.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.776 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.604 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 0.3 OUTLIER -104.95 114.6 28.91 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.978 0.418 . . . . 0.0 111.04 -177.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -86.9 99.12 11.62 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.182 176.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.2 mt -85.39 113.03 21.38 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.868 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -74.65 112.67 11.08 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.572 HG13 ' HA ' ' A' ' 95' ' ' PRO . 1.3 pt -131.88 123.05 50.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.815 -171.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.0 mtmm -102.68 98.93 8.89 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.898 HD23 ' HD2' ' A' ' 91' ' ' PHE . 4.9 tp -93.62 113.07 25.08 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-O 121.045 0.45 . . . . 0.0 110.343 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.64 150.08 87.36 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.226 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.802 ' HA ' ' HZ ' ' A' ' 91' ' ' PHE . 16.3 Cg_endo -58.28 -6.94 3.3 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 123.206 2.604 . . . . 0.0 113.086 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.91 -4.11 56.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.734 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.4 62.65 2.04 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.54 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.99 139.58 9.95 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.517 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.1 OUTLIER -88.93 104.84 17.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.87 0.367 . . . . 0.0 111.0 -178.065 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.09 -37.94 28.12 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.155 0.502 . . . . 0.0 109.966 177.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -124.51 121.95 36.26 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.108 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.436 ' HA ' ' O ' ' A' ' 45' ' ' ARG . 4.2 tt -143.35 110.35 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.879 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -140.79 143.39 31.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.356 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.536 ' HG3' HD22 ' A' ' 71' ' ' LEU . 8.8 Cg_exo -70.54 103.73 1.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 122.246 1.964 . . . . 0.0 111.33 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -70.33 -49.67 47.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.055 0.455 . . . . 0.0 110.025 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -173.71 137.74 4.21 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.843 177.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.604 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 168.61 -102.7 0.19 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.429 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -143.01 128.15 9.97 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -55.48 -37.22 95.14 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.799 2.333 . . . . 0.0 112.907 -177.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -76.99 -48.95 16.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.71 HD13 ' HB2' ' A' ' 37' ' ' TYR . 34.6 tp -63.33 -45.04 93.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.459 ' O ' HD23 ' A' ' 71' ' ' LEU . 4.1 m -65.39 -43.89 89.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.795 -175.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -57.33 -49.81 74.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.742 0.306 . . . . 0.0 110.739 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.66 -29.17 70.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.662 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -81.16 -51.58 8.29 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.532 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.536 HD22 ' HG3' ' A' ' 59' ' ' PRO . 0.9 OUTLIER -65.31 -39.22 92.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.318 -176.135 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.566 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . . . -66.48 -39.13 88.59 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.1 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.631 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -74.06 -33.45 63.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.427 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.0 -28.89 68.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 72' ' ' ALA . 8.9 mttm -71.75 -22.78 61.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.071 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' A' ' 76' ' ' LEU . 0.3 OUTLIER -100.95 -19.97 15.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.174 -177.548 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.41 132.94 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.562 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 91.23 8.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.518 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.457 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 38.7 mm -72.22 121.64 85.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.359 179.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 29.5 Cg_exo -64.11 153.19 77.64 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.823 2.349 . . . . 0.0 112.042 -177.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 135.25 88.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 116.21 3.03 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.124 2.55 . . . . 0.0 113.179 -173.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -79.64 -50.01 0.07 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.655 2.237 . . . . 0.0 112.157 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.85 156.8 23.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.772 0.32 . . . . 0.0 110.863 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.89 -27.48 57.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.932 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.587 ' O ' HG23 ' A' ' 90' ' ' VAL . . . -60.76 -40.77 93.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.69 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.2 t -61.9 -42.55 95.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 177.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.548 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 0.7 OUTLIER -58.79 -32.26 69.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.524 178.472 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.514 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 2.7 mm-40 -75.91 -30.23 58.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.885 -177.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.629 HG22 ' H ' ' A' ' 11' ' ' ALA . 5.4 t -92.42 -53.42 8.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -173.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.898 ' HD2' HD23 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -61.72 -13.11 20.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -168.707 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 1.3 ptpt -75.33 -13.63 60.43 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.952 -177.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -169.21 22.16 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.616 ' HB3' HG12 ' A' ' 90' ' ' VAL . . . -121.38 123.64 27.57 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 121.752 -0.592 . . . . 0.0 111.27 177.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.868 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 23.3 Cg_exo -72.7 156.78 53.06 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.191 2.594 . . . . 0.0 112.204 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.75 132.79 40.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.419 -175.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 112.64 19.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.305 174.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -106.35 122.78 46.95 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.296 0.569 . . . . 0.0 110.843 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.545 ' HB2' ' HD2' ' A' ' 100' ' ' PRO . 0.1 OUTLIER -150.66 163.32 24.38 Favored Pre-proline 0 C--N 1.312 -1.024 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.499 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.791 ' HG3' ' HA ' ' A' ' 38' ' ' ALA . 5.9 Cg_exo -40.07 106.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.647 2.898 . . . . 0.0 112.324 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 16.1 p80 -67.28 153.15 44.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.479 -173.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 9.0 p80 . . . . . 0 C--O 1.248 0.983 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.098 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 2' ' ' GLU . . . . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 1' ' ' ALA . 2.0 mp0 70.27 -57.91 0.56 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.486 172.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.66 164.52 36.75 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.54 84.83 0.53 Allowed Glycine 0 N--CA 1.451 -0.304 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -80.33 48.17 0.99 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.156 0.503 . . . . 0.0 111.296 -174.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.14 -43.06 22.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.506 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 56.95 -137.75 1.0 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.35 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -116.25 85.28 2.27 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -92.59 122.33 34.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.745 -0.662 . . . . 0.0 112.155 -171.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.46 -41.98 0.6 Allowed Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.787 176.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -91.73 96.68 10.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.965 0.412 . . . . 0.0 110.737 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.55 117.86 13.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.16 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -123.16 -139.63 5.51 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.193 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -129.67 -55.13 1.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.002 0.429 . . . . 0.0 110.942 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.23 -20.63 63.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.984 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.562 ' HA ' HG22 ' A' ' 87' ' ' VAL . 13.9 mt -67.01 -47.8 81.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.922 0.391 . . . . 0.0 110.365 174.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -34.05 70.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.112 0.482 . . . . 0.0 109.926 177.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -63.81 -39.74 94.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.881 179.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.43 -40.34 82.24 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.083 179.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.86 -49.67 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.266 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.78 -31.58 73.21 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.052 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -34.12 70.73 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.606 0.241 . . . . 0.0 110.676 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 60.0 mt -66.39 -41.44 88.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.13 83.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.821 176.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.6 m -66.79 -38.14 85.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 0.0 110.569 176.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.04 -34.95 77.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.214 0.531 . . . . 0.0 110.779 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 5.5 mt -83.32 -56.25 6.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.626 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HA ' ' HB2' ' A' ' 31' ' ' PHE . 43.6 mt-10 -75.48 -22.32 57.32 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.595 -170.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -80.42 8.48 7.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.698 -0.627 . . . . 0.0 110.288 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.98 12.39 11.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 172.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.592 ' CG ' ' HB3' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -108.87 137.61 46.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.508 -177.248 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.4 ' HB3' ' H ' ' A' ' 33' ' ' ASP . 2.3 t80 -85.6 -83.81 0.17 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.814 0.34 . . . . 0.0 111.004 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.4 ' H ' ' HB3' ' A' ' 32' ' ' TYR . 12.6 t0 -78.31 -18.36 55.32 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.546 0.688 . . . . 0.0 111.371 -176.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.616 ' HA ' ' CD2' ' A' ' 37' ' ' TYR . . . -77.28 -29.4 53.82 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.873 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -17.8 63.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.002 0.43 . . . . 0.0 110.797 177.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 m -109.41 20.94 17.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.961 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.616 ' CD2' ' HA ' ' A' ' 34' ' ' ALA . 5.1 m-30 -96.45 173.26 7.45 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.677 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.435 ' HA ' ' HG2' ' A' ' 100' ' ' PRO . . . -172.72 166.53 5.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.833 175.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.81 43.4 91.73 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.333 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.2 mmtt -137.94 158.92 43.34 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.26 138.7 40.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.885 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.44 93.38 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.159 0.504 . . . . 0.0 111.65 -176.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.6 m -76.49 113.78 14.47 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.216 177.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.672 HD11 ' HB2' ' A' ' 98' ' ' PHE . 0.0 OUTLIER -113.22 125.62 54.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.799 0.333 . . . . 0.0 110.536 177.491 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.927 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 12.4 ttm105 -78.48 98.35 6.03 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.023 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 1.1 pt -105.33 155.32 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.256 -176.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.67 103.08 5.11 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.004 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -81.82 138.43 35.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.973 0.415 . . . . 0.0 110.991 -177.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.545 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.82 163.76 17.43 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.638 176.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.545 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 33.3 Cg_endo -62.43 -11.89 25.07 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.348 2.032 . . . . 0.0 112.062 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.41 -4.35 59.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.912 177.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.96 10.55 84.86 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.606 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.46 154.12 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.744 0.307 . . . . 0.0 110.473 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.36 102.07 14.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.093 179.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.478 HD11 ' HB2' ' A' ' 49' ' ' ALA . 0.8 OUTLIER -65.2 -42.78 93.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.143 0.497 . . . . 0.0 110.248 -179.6 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -128.31 144.26 51.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.2 tt -158.1 106.34 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.365 0.602 . . . . 0.0 109.408 177.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -135.15 123.63 15.82 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.032 -174.029 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.592 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 21.6 Cg_exo -65.64 120.7 7.93 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.974 2.449 . . . . 0.0 112.15 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.9 -61.86 1.86 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -166.63 -176.71 37.95 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.029 177.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.5 -89.22 0.43 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 -178.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.417 ' HA ' ' HD2' ' A' ' 64' ' ' PRO . 13.1 t70 -133.91 110.29 12.01 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 120.78 0.324 . . . . 0.0 110.518 176.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 63' ' ' ASP . 11.0 Cg_endo -55.99 -36.08 95.43 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 122.717 2.278 . . . . 0.0 112.787 -177.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.84 -53.09 12.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.307 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.915 0.388 . . . . 0.0 110.9 -178.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.592 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 8.5 m -64.74 -42.59 95.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.606 -178.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -68.82 -33.59 74.09 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.775 0.321 . . . . 0.0 110.933 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.54 69.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 178.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.07 71.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 15.2 mt -61.16 -37.06 81.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.788 0.327 . . . . 0.0 111.14 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.27 -40.93 77.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.873 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.13 74.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.035 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.56 -26.91 68.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.383 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -78.05 -22.74 48.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.7 mt -99.39 -11.4 21.19 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.501 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.11 125.69 27.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.278 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.91 99.14 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.812 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.4 mt -112.89 124.72 31.11 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.616 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.7 168.41 19.5 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.55 2.167 . . . . 0.0 112.651 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 1.5 ttmt -66.92 127.73 93.61 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.4 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 7.0 Cg_endo -50.86 110.84 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.31 2.673 . . . . 0.0 112.577 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.74 -27.86 12.16 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.62 2.214 . . . . 0.0 111.457 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.5 ' HB2' HG23 ' A' ' 87' ' ' VAL . 0.6 OUTLIER -107.54 120.05 41.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.154 177.865 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -60.99 -32.07 71.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.12 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.68 78.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.92 0.391 . . . . 0.0 110.913 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.562 HG22 ' HA ' ' A' ' 16' ' ' ILE . 91.0 t -66.6 -44.62 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -62.41 -43.38 98.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.969 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.831 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 3.3 mm-40 -58.05 -32.52 68.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.31 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.23 -58.2 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.452 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -65.43 -18.94 65.71 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.831 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.73 -13.81 61.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.816 0.341 . . . . 0.0 110.918 179.85 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -153.08 46.78 0.69 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 110.695 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.82 101.3 11.7 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.812 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.927 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 14.6 Cg_exo -72.45 131.75 18.03 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.848 2.365 . . . . 0.0 111.53 -178.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.66 146.03 25.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.251 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -97.07 96.71 8.66 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.967 175.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.672 ' HB2' HD11 ' A' ' 44' ' ' LEU . 48.9 t80 -73.16 108.86 6.29 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.419 -173.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.69 135.73 25.43 Favored Pre-proline 0 C--N 1.315 -0.902 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.435 ' HG2' ' HA ' ' A' ' 38' ' ' ALA . 51.1 Cg_exo -36.19 126.04 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.913 3.075 . . . . 0.0 113.388 -175.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.414 ' HB3' ' OE2' ' A' ' 28' ' ' GLU . 12.4 p80 -58.3 159.39 6.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.3 -173.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.172 -0.918 . . . . 0.0 109.297 174.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 70.51 -64.36 0.37 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.891 0.744 . . . . 0.0 110.893 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -100.65 138.43 37.71 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.68 24.93 4.14 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.075 -177.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 61.2 t30 54.22 76.16 0.25 Allowed 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.867 0.467 . . . . 0.0 111.774 177.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.483 HG21 ' HB2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -76.99 62.56 2.15 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.205 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.69 141.18 29.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.881 -177.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -86.6 68.94 10.31 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.371 0.605 . . . . 0.0 109.512 175.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -76.06 -28.73 57.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.277 -176.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -105.19 -127.09 5.89 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.336 174.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.7 43.49 2.73 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.973 0.416 . . . . 0.0 110.494 178.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.83 88.04 2.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.748 -178.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.35 -5.75 8.48 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.976 -176.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.81 -31.21 64.48 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.836 0.35 . . . . 0.0 111.812 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -75.99 -54.38 6.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.054 0.454 . . . . 0.0 110.428 178.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.412 HG23 ' CE2' ' A' ' 91' ' ' PHE . 3.2 mt -65.34 -48.06 84.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.447 -175.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -63.36 -37.89 89.04 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -175.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.11 -33.84 76.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.028 0.442 . . . . 0.0 110.413 178.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -73.67 -48.7 30.29 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.697 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -63.81 -34.19 77.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.993 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.14 -35.95 91.19 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.191 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -65.85 -42.56 90.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.845 0.355 . . . . 0.0 110.994 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.551 HD12 ' HA ' ' A' ' 20' ' ' ALA . 44.8 mt -57.93 -44.29 86.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.37 -178.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.2 mttp -55.16 -44.27 75.0 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.541 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.55 -36.67 44.34 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.975 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.17 -38.31 79.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.677 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 23' ' ' ILE . 6.3 mt -65.43 -38.32 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.985 -178.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -19.28 62.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.415 177.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -68.99 -23.64 64.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.149 0.5 . . . . 0.0 110.04 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 14.6 mmmt -96.18 -48.38 5.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.572 174.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.736 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 5.1 m-30 -89.97 89.16 7.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.852 176.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -60.56 86.52 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.855 0.359 . . . . 0.0 111.59 -176.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.4 t70 61.82 16.63 8.1 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.878 0.846 . . . . 0.0 110.623 -176.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.736 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -80.71 -42.41 21.98 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.926 178.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.56 -22.77 65.38 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.463 177.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.98 65.8 1.12 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.366 176.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.495 ' HD1' ' HA ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -99.7 -47.05 5.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.348 -173.643 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.549 ' H ' ' HG2' ' A' ' 100' ' ' PRO . . . 68.62 152.52 0.09 Allowed 'General case' 0 N--CA 1.464 0.246 0 O-C-N 124.092 0.87 . . . . 0.0 111.143 -177.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.9 -37.79 2.68 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.187 -0.53 . . . . 0.0 111.962 -176.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.3 129.65 39.32 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.521 HG23 ' HG2' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -121.99 145.33 48.23 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.8 106.49 4.26 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.693 -177.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.605 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 20.0 m -78.94 113.33 16.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.661 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -108.63 114.25 27.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.196 -176.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.872 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 21.8 ttm180 -79.42 89.07 5.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.7 pt -95.28 111.88 26.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.569 -172.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -93.94 99.44 11.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.37 177.191 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.712 ' HG ' HD23 ' A' ' 54' ' ' LEU . 4.9 mt -85.33 139.51 31.52 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.126 0.489 . . . . 0.0 111.379 -175.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.446 ' HB2' ' CD2' ' A' ' 55' ' ' LEU . . . -96.0 158.8 33.55 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.279 177.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.7 ' HG3' ' HE1' ' A' ' 88' ' ' TYR . 32.4 Cg_exo -56.0 -24.09 46.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.966 2.444 . . . . 0.0 112.564 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.434 ' HB2' ' HG2' ' A' ' 53' ' ' MET . 1.4 m-20 -75.19 -9.08 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.127 -178.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 44.75 6.48 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.774 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.434 ' HG2' ' HB2' ' A' ' 51' ' ' ASP . 1.4 ptt? -150.81 142.46 23.63 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.712 HD23 ' HG ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -88.54 101.58 14.08 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.352 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.446 ' CD2' ' HB2' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -71.87 -37.22 70.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.894 0.378 . . . . 0.0 110.286 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 47' ' ' LYS . 10.1 t70 -123.73 100.13 6.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 177.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 4.6 tt -111.57 106.18 20.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -113.94 119.96 39.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.611 -170.347 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.684 ' HG3' HD21 ' A' ' 71' ' ' LEU . 2.7 Cg_exo -71.51 110.9 2.98 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.694 2.263 . . . . 0.0 111.176 175.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.419 ' HB2' ' HB ' ' A' ' 43' ' ' THR . 45.7 mt-10 -73.8 -49.21 26.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.209 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 173.22 172.9 39.17 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.472 178.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.8 -90.66 0.24 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -143.45 112.34 5.5 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -56.32 -35.01 95.44 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.953 2.435 . . . . 0.0 112.275 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.81 83.38 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.283 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.0 tp -88.05 -40.4 13.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.626 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.599 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 1.6 m -60.64 -55.07 37.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.298 -175.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HA ' HD12 ' A' ' 71' ' ' LEU . 1.0 OUTLIER -61.99 -29.72 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.681 0.277 . . . . 0.0 111.455 -176.51 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.95 -44.06 27.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.928 0.394 . . . . 0.0 110.851 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.99 -28.97 69.94 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.464 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.684 HD21 ' HG3' ' A' ' 59' ' ' PRO . 91.2 mt -54.58 -44.84 73.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.652 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.6 -41.19 32.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 178.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.4 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -57.68 -50.05 74.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.99 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.19 64.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.85 0.357 . . . . 0.0 111.49 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.641 ' HG2' HD12 ' A' ' 54' ' ' LEU . 2.8 mtmt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 179.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.417 ' HB3' ' HE2' ' A' ' 30' ' ' LYS . 4.7 mp -94.6 -19.76 20.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.878 -177.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.44 158.4 26.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.673 -175.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.03 73.84 5.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.685 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.433 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.9 mm -76.3 120.07 80.04 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.712 178.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 33.7 Cg_exo -63.58 171.56 6.74 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.594 2.196 . . . . 0.0 112.339 -177.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.445 ' HG3' ' HD2' ' A' ' 82' ' ' PRO . 1.1 tppt? -90.98 135.01 29.14 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 175.162 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.445 ' HD2' ' HG3' ' A' ' 81' ' ' LYS . 78.4 Cg_exo -44.16 111.57 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.396 2.731 . . . . 0.0 112.785 -178.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -62.99 -66.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.721 2.28 . . . . 0.0 112.25 -176.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.33 -179.37 3.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.778 0.323 . . . . 0.0 110.637 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -16.49 61.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.073 -177.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.31 -57.8 9.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.467 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.7 t -60.51 -37.57 75.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.63 177.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.7 ' HE1' ' HG3' ' A' ' 50' ' ' PRO . 29.3 t80 -54.0 -52.83 59.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.636 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.531 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 44.6 mm-40 -77.89 -40.81 38.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 111.534 -177.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.68 -52.56 22.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.981 -173.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.525 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 2.2 m-85 -72.69 -5.21 36.03 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -176.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 7.4 mtmt -65.92 -21.34 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 171.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.87 55.37 0.66 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.709 179.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.525 ' HB3' ' HA ' ' A' ' 91' ' ' PHE . . . -123.26 93.53 47.89 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -178.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.872 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 15.4 Cg_exo -73.73 140.08 28.78 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 123.013 2.475 . . . . 0.0 111.941 -178.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.35 135.08 55.14 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.57 -177.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.605 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 25.5 t0 -84.09 103.32 13.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 175.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.61 108.62 3.92 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.082 -175.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.521 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -119.9 116.82 32.69 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.536 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.549 ' HG2' ' H ' ' A' ' 38' ' ' ALA . 51.7 Cg_exo -36.06 114.5 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 124.103 3.202 . . . . 0.0 113.356 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -88.56 142.72 27.46 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.507 -178.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 . . . . . 0 C--O 1.247 0.971 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.069 -179.61 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 121.188 0.518 . . . . 0.0 109.915 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -101.52 134.05 45.22 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.317 -174.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -80.93 46.72 0.92 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.66 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 52.84 46.47 60.28 Favored Glycine 0 C--N 1.333 0.378 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.878 177.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -66.19 119.83 12.16 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.827 0.346 . . . . 0.0 110.539 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.98 84.92 0.22 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.767 -176.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.39 -77.7 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.521 178.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -110.72 -1.6 16.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.164 0.507 . . . . 0.0 109.897 175.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -120.01 168.85 10.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.968 177.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.25 -106.65 1.21 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.204 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -157.71 161.54 38.54 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.26 59.72 1.83 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.255 0.55 . . . . 0.0 111.004 -179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -178.68 38.06 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.002 -178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -101.33 142.84 32.14 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.484 -0.191 . . . . 0.0 110.484 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 65.22 -71.2 0.08 Allowed 'General case' 0 N--CA 1.469 0.485 0 O-C-N 123.92 0.763 . . . . 0.0 112.365 177.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -55.62 -50.81 64.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.899 0.38 . . . . 0.0 111.6 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -35.36 78.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.973 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -66.47 -48.36 70.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.73 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -57.88 -40.45 80.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.298 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.19 -35.56 77.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.765 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.79 -37.12 88.28 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.571 177.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.06 -37.15 86.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.889 0.376 . . . . 0.0 110.632 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 36.1 mt -73.29 -40.07 56.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.409 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.72 -38.0 71.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.433 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.54 -42.81 28.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.867 0.365 . . . . 0.0 110.704 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.61 -47.31 86.07 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.406 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.446 HG23 ' HB1' ' A' ' 73' ' ' ALA . 4.6 mt -64.39 -39.33 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.311 -178.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -21.18 64.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.459 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.44 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 4.3 m -96.53 17.81 15.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.117 0.484 . . . . 0.0 110.691 177.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 29' ' ' SER . 10.1 mmtt -150.81 32.14 0.62 Allowed 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -62.07 -41.85 98.59 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 113.487 -1.688 . . . . 0.0 113.013 -167.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 69.83 -66.38 0.27 Allowed 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -170.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -149.7 25.34 0.85 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.967 0.889 . . . . 0.0 109.999 170.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.56 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . . . -78.85 -18.91 53.23 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.359 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 p -65.89 -17.82 64.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.522 0.677 . . . . 0.0 110.291 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m -79.35 52.58 1.37 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.616 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.572 ' CD1' ' HB3' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -110.64 -154.12 0.53 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.974 -179.627 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.648 ' H ' ' HG3' ' A' ' 100' ' ' PRO . . . 73.33 118.59 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.736 0.814 . . . . 0.0 111.062 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.02 -22.78 34.1 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -171.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.723 ' HB2' HD23 ' A' ' 66' ' ' LEU . 23.2 mttm -117.65 150.95 38.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.1 -0.55 . . . . 0.0 110.38 176.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.17 149.09 39.27 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.42 ' HA ' ' HA3' ' A' ' 62' ' ' GLY . 33.4 t -152.37 116.6 4.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.041 0.448 . . . . 0.0 111.816 -178.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.896 ' HA ' ' HA ' ' A' ' 97' ' ' ASP . 3.9 m -76.03 121.43 22.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.42 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.7 mt -105.61 129.48 53.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 0.0 110.252 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HB3' ' HD2' ' A' ' 58' ' ' LYS . 8.6 ttt-85 -86.86 93.3 9.26 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.82 113.68 34.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.304 -173.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -101.01 100.86 11.53 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 175.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 91' ' ' PHE . 35.2 mt -93.15 130.03 38.94 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.947 -175.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.742 ' HB3' ' HG3' ' A' ' 53' ' ' MET . . . -76.39 138.72 67.57 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 172.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -55.65 -17.82 18.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.349 2.699 . . . . 0.0 113.342 -175.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -81.32 -0.41 40.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.328 . . . . 0.0 111.174 178.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.67 63.88 1.52 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.564 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.742 ' HG3' ' HB3' ' A' ' 49' ' ' ALA . 1.8 ptp -159.68 135.61 8.68 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.648 HD21 HD13 ' A' ' 79' ' ' ILE . 0.0 OUTLIER -91.26 87.82 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.155 0.503 . . . . 0.0 110.043 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.477 ' HG ' ' N ' ' A' ' 56' ' ' ASP . 0.4 OUTLIER -76.59 -29.43 56.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.378 -178.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.477 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 29.7 t70 -130.52 92.52 3.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.38 -178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 tt -124.36 106.71 17.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.609 ' HD2' ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -134.3 142.6 43.6 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.47 -173.14 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.483 ' HB3' ' HB3' ' A' ' 67' ' ' CYS . 8.9 Cg_exo -69.82 132.29 22.92 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.055 2.503 . . . . 0.0 111.504 177.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -98.98 -76.58 0.53 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.418 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -133.14 145.69 17.67 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.467 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 42' ' ' CYS . . . 135.69 -154.26 21.71 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.187 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -88.53 120.46 70.32 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -56.01 -27.27 63.31 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.99 2.46 . . . . 0.0 112.859 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.29 -42.64 75.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.706 0.289 . . . . 0.0 110.43 176.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.723 HD23 ' HB2' ' A' ' 40' ' ' LYS . 0.3 OUTLIER -61.61 -43.17 99.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.716 174.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.559 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 8.8 m -63.07 -56.23 18.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.506 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -38.11 84.91 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.602 -174.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.56 ' HB1' ' HA ' ' A' ' 34' ' ' ALA . . . -65.53 -41.8 92.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.216 177.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -66.82 -38.98 87.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.021 177.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 67' ' ' CYS . 17.8 mt -57.1 -51.35 69.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.929 0.395 . . . . 0.0 110.859 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.44 -44.01 92.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.033 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.446 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -64.74 -40.42 95.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.443 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.93 -33.8 76.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.73 0.3 . . . . 0.0 111.293 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.42 -26.32 60.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.01 0.433 . . . . 0.0 110.635 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.453 HD13 ' HA ' ' A' ' 76' ' ' LEU . 1.3 mm? -88.01 -31.92 19.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.701 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.99 170.63 12.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.354 0.597 . . . . 0.0 111.821 -176.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -114.87 106.3 14.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.552 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.648 HD13 HD21 ' A' ' 54' ' ' LEU . 3.6 mp -103.77 110.4 63.86 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 18.9 Cg_exo -69.63 153.25 69.78 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.842 2.361 . . . . 0.0 112.558 -175.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -70.54 126.99 92.39 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.501 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.94 112.32 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.954 2.436 . . . . 0.0 113.218 -175.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -77.52 -21.34 11.6 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.62 2.213 . . . . 0.0 111.33 178.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -97.66 143.25 28.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.074 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.8 mm-40 -72.17 -27.62 62.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.758 0.313 . . . . 0.0 110.862 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.57 -52.03 65.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.284 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.417 ' O ' ' HB2' ' A' ' 91' ' ' PHE . 53.3 t -67.49 -37.15 78.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.627 177.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.472 ' O ' ' HG3' ' A' ' 92' ' ' LYS . 4.8 t80 -53.72 -50.87 64.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.355 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -78.29 -27.12 47.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.093 -174.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.2 t -87.19 -43.01 15.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.896 -0.321 . . . . 0.0 111.507 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 48' ' ' LEU . 2.5 m-85 -77.8 -0.87 28.78 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -174.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 88' ' ' TYR . 8.5 mttt -57.29 -30.35 64.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.214 0.53 . . . . 0.0 110.478 176.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.528 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 2.8 t-20 -158.3 76.08 0.75 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.465 172.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -107.68 95.35 14.06 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.342 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.528 ' HD3' ' O ' ' A' ' 93' ' ' ASN . 8.0 Cg_exo -73.6 104.5 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.651 2.234 . . . . 0.0 110.448 179.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.8 130.47 46.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.783 -173.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.896 ' HA ' ' HA ' ' A' ' 43' ' ' THR . 32.9 t70 -75.13 102.1 4.81 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -70.38 116.98 11.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.37 0.605 . . . . 0.0 110.48 -175.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 4.7 tttt -131.62 128.05 21.67 Favored Pre-proline 0 C--N 1.312 -1.046 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.655 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.648 ' HG3' ' H ' ' A' ' 38' ' ' ALA . 3.2 Cg_exo -33.23 118.72 0.1 OUTLIER 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.861 3.707 . . . . 0.0 111.837 177.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.87 145.68 52.03 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.379 -0.828 . . . . 0.0 112.457 -166.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 . . . . . 0 C--O 1.243 0.761 0 CA-C-N 114.76 -1.109 . . . . 0.0 108.672 175.838 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -59.89 110.16 1.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.653 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 68.74 -75.79 0.06 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.698 0.799 . . . . 0.0 112.099 178.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.25 -126.88 8.81 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 -172.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -118.11 75.45 1.01 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.757 0.313 . . . . 0.0 110.322 174.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 8' ' ' ASN . 1.1 m 61.92 112.69 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.582 178.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.55 16.98 8.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.339 0.59 . . . . 0.0 110.32 176.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.419 ' H ' HG22 ' A' ' 6' ' ' THR . 3.2 t30 -113.32 134.9 54.38 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.857 177.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.4 t30 63.75 44.56 4.93 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.333 0.587 . . . . 0.0 110.103 -176.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.8 -163.45 14.34 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.502 -175.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -171.92 -114.01 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 87.68 5.29 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 172.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.26 51.4 2.49 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.927 -0.579 . . . . 0.0 113.388 -172.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' A' ' 18' ' ' ASN . . . -65.72 -25.37 67.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.045 0.45 . . . . 0.0 109.942 175.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -57.7 3.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.399 176.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.476 HG12 HG23 ' A' ' 87' ' ' VAL . 52.8 mt -57.88 -46.66 87.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.45 -178.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.69 -39.97 86.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.987 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.5 t30 -71.96 -41.47 67.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.037 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -62.9 -40.02 96.28 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.423 ' HA ' HD12 ' A' ' 23' ' ' ILE . . . -62.76 -37.33 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.783 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.24 -39.58 43.69 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.386 178.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -62.68 -26.46 68.67 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.285 0.234 . . . . 0.0 111.429 -178.291 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 20' ' ' ALA . 65.2 mt -62.91 -39.22 84.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.233 0.539 . . . . 0.0 110.03 177.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' CE1' ' A' ' 101' ' ' HIS . 29.7 mttt -74.07 -28.99 61.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.179 178.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -67.7 -39.33 84.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.725 0.298 . . . . 0.0 110.691 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' A' ' 77' ' ' ALA . . . -58.76 -31.78 68.67 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.476 178.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.618 HG23 ' HB3' ' A' ' 73' ' ' ALA . 43.2 mt -66.18 -31.65 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.665 -176.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.692 ' HA ' ' OG ' ' A' ' 35' ' ' SER . 0.8 OUTLIER -71.69 -33.1 68.53 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.108 -0.37 . . . . 0.0 111.108 179.495 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -70.24 4.8 1.99 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.761 178.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HD3' ' HA ' ' A' ' 77' ' ' ALA . 1.6 mmmt -119.36 -0.54 10.92 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.593 ' HB3' ' HB3' ' A' ' 34' ' ' ALA . 0.2 OUTLIER -123.4 -30.51 3.66 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.384 -176.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.429 ' C ' ' H ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER 66.77 75.84 0.31 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 122.819 0.448 . . . . 0.0 110.945 179.204 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' ' 36' ' ' SER . 0.0 OUTLIER 60.25 5.01 0.74 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 122.181 0.991 . . . . 0.0 112.224 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.593 ' HB3' ' HB3' ' A' ' 31' ' ' PHE . . . -78.35 -30.96 48.36 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.492 173.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.692 ' OG ' ' HA ' ' A' ' 28' ' ' GLU . 0.7 OUTLIER -68.76 -17.87 64.11 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.823 176.072 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' A' ' 33' ' ' ASP . 39.4 m -76.39 69.74 2.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.998 175.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -88.36 -157.27 0.41 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.952 -175.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.633 ' O ' ' HG3' ' A' ' 100' ' ' PRO . . . -75.32 165.63 24.86 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.011 174.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -70.4 61.03 0.85 Allowed Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.382 -0.437 . . . . 0.0 113.141 178.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.434 ' HB2' HD22 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -94.8 166.24 12.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 178.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.1 m -118.13 121.2 39.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.911 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.452 ' HB3' ' HB3' ' A' ' 98' ' ' PHE . 6.0 t -115.91 151.09 36.0 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -137.56 102.2 4.7 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 0.0 110.387 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mt -101.14 136.12 41.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.409 -179.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.794 ' HA ' ' HB3' ' A' ' 95' ' ' PRO . 4.1 ptm180 -85.21 124.91 32.4 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -127.7 111.09 23.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 121.167 0.508 . . . . 0.0 111.168 -173.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 92' ' ' LYS . 29.1 ttmt -108.0 104.22 13.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.373 -0.83 . . . . 0.0 108.891 176.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 tp -96.37 142.55 28.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.145 0.498 . . . . 0.0 111.898 -173.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.617 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -100.19 166.13 13.24 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.824 176.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.617 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 25.8 Cg_endo -61.81 -10.15 16.28 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.756 2.304 . . . . 0.0 112.703 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.35 -6.61 59.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.477 177.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 81' ' ' LYS . . . 78.36 16.92 78.8 Favored Glycine 0 CA--C 1.51 -0.25 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.89 -177.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -104.84 146.25 29.26 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 54' ' ' LEU . 0.0 OUTLIER -90.12 101.74 14.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.039 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.95 -28.06 60.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.094 0.473 . . . . 0.0 110.07 -178.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.593 ' HB3' ' HB3' ' A' ' 47' ' ' LYS . 28.7 t70 -128.93 104.15 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.538 175.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -133.76 111.74 15.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.34 148.09 15.19 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.408 -174.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.617 ' HD3' HD11 ' A' ' 71' ' ' LEU . 39.3 Cg_endo -70.34 112.91 3.3 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 121.964 1.776 . . . . 0.0 111.656 177.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -73.45 -34.85 65.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.411 0.624 . . . . 0.0 109.589 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 176.88 -177.23 48.2 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.401 177.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.25 -150.84 17.43 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.013 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.3 112.55 42.3 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.784 0.326 . . . . 0.0 110.303 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -57.46 -40.26 82.54 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.339 2.693 . . . . 0.0 113.399 -174.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.0 -46.71 86.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.951 0.405 . . . . 0.0 111.188 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.434 HD22 ' HB2' ' A' ' 40' ' ' LYS . 16.3 tp -65.61 -38.9 90.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.553 178.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.551 ' HB3' ' HB3' ' A' ' 59' ' ' PRO . 24.9 m -67.93 -44.72 76.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.265 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.718 ' HA ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -62.17 -38.77 90.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.702 0.286 . . . . 0.0 110.822 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.478 ' HB1' ' CE2' ' A' ' 31' ' ' PHE . . . -60.73 -44.76 96.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.642 178.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.93 -38.3 82.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.075 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 68' ' ' GLN . 51.7 mt -53.52 -46.64 70.18 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.708 -177.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.13 -37.24 46.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.554 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.618 ' HB3' HG23 ' A' ' 27' ' ' ILE . . . -75.64 -39.6 57.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.112 -175.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -32.01 73.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -176.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -67.91 -30.56 69.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.0 110.966 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 57.3 mt -98.23 -2.59 39.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.541 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . . . -78.02 149.07 34.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.442 -179.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.95 66.45 6.48 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -178.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 53.4 mt -78.51 116.71 61.53 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.878 176.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 79' ' ' ILE . 23.4 Cg_exo -67.29 151.53 80.66 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 123.011 2.474 . . . . 0.0 112.761 -175.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.508 ' H ' ' HG3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -73.86 138.62 76.52 Favored Pre-proline 0 N--CA 1.443 -0.821 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.453 175.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.04 106.92 0.22 Allowed 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.114 2.543 . . . . 0.0 112.835 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -77.16 -25.1 8.96 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.601 2.201 . . . . 0.0 111.832 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.42 135.26 54.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.695 177.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -66.51 -27.83 68.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.956 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.4 -37.26 86.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.141 0.496 . . . . 0.0 110.75 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.476 HG23 HG12 ' A' ' 16' ' ' ILE . 0.8 OUTLIER -71.99 -33.92 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.292 177.57 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -69.66 -31.63 69.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.514 176.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.898 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -65.9 -35.38 80.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.396 179.295 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t -79.69 -45.89 22.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.566 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -77.29 5.32 8.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.178 -176.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.898 ' HE3' ' HA ' ' A' ' 89' ' ' GLU . 6.1 ttmt -63.7 -23.69 67.47 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.229 0.538 . . . . 0.0 110.117 176.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -170.07 75.15 0.08 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.292 175.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.453 ' HB2' ' O ' ' A' ' 90' ' ' VAL . . . -122.09 85.2 46.02 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.452 -173.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.794 ' HB3' ' HA ' ' A' ' 45' ' ' ARG . 12.6 Cg_exo -73.05 104.51 1.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.747 2.298 . . . . 0.0 110.725 178.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 41.6 mt -95.24 158.84 15.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.823 -172.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -80.07 146.67 31.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.258 177.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.452 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 64.7 t80 -129.55 130.84 46.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.029 0.443 . . . . 0.0 110.507 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.51 165.6 34.23 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.633 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 28.4 Cg_endo -60.45 90.44 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.406 2.07 . . . . 0.0 113.202 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.482 ' CE1' ' HB2' ' A' ' 24' ' ' LYS . 1.5 t60 -53.04 128.18 26.56 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.42 -178.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 . . . . . 0 C--O 1.246 0.887 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.336 177.018 . . . . . . . . 0 0 . 1 stop_ save_