data_2lsr_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 2lsr _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tpp85 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.863 0.363 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.03 -33.73 73.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.854 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.7 t -64.24 -35.58 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.71 -51.0 38.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.995 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.412 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.31 -26.84 68.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.229 179.313 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -70.76 -47.69 58.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.475 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.545 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.58 -44.53 67.18 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -43.87 77.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.736 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.412 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 9.6 m170 -60.13 -41.14 92.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.085 0.469 . . . . 0.0 109.952 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -61.22 -37.55 83.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.129 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.402 ' O ' ' N ' ' A' ' 17' ' ' ILE . 47.0 t -59.97 -49.13 85.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.392 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.66 -37.54 73.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.178 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -68.84 -37.12 78.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.699 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 mt -97.72 8.96 43.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.535 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.402 ' N ' ' O ' ' A' ' 13' ' ' VAL . 36.7 mm -149.76 69.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-O 121.731 0.777 . . . . 0.0 110.112 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.803 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.83 160.72 16.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.724 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.73 -29.42 14.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.969 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.98 -53.64 54.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -50.91 -34.84 30.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.412 ' O ' ' CG ' ' A' ' 27' ' ' TYR . 8.2 mttm -73.52 -34.78 65.4 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.905 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -65.42 -43.8 89.36 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.15 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -64.37 -41.3 96.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.205 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.37 -39.85 95.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.359 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.412 ' CG ' ' O ' ' A' ' 23' ' ' LYS . 20.6 m-85 -60.29 -43.8 95.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.495 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -64.66 -34.43 78.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.498 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.403 ' CG1' ' CD2' ' A' ' 42' ' ' LEU . 17.5 t -67.82 -43.41 86.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.783 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.1 mt -66.12 -42.51 89.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.628 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -32.93 74.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.624 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.405 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 70.9 mmm -66.66 -47.06 73.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.453 ' CG ' ' CD1' ' A' ' 42' ' ' LEU . 13.3 t80 -59.37 -40.83 87.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.038 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -67.86 -43.39 79.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.346 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.405 ' HG2' ' HA ' ' A' ' 32' ' ' MET . 19.4 pt20 -77.24 -50.0 13.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.901 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.3 p -78.08 -30.5 49.64 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.42 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.2 mmt 62.64 28.73 16.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.952 0.406 . . . . 0.0 110.718 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -119.53 122.31 41.35 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.45 ' CG1' ' CD1' ' A' ' 74' ' ' TYR . 14.9 t -78.66 -7.27 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.537 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.0 -36.99 58.96 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.091 0.472 . . . . 0.0 110.22 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.95 -34.03 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.959 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.453 ' CD1' ' CG ' ' A' ' 33' ' ' TYR . 1.3 mt -65.52 -46.34 80.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.844 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.4 t -57.54 -45.73 86.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.423 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.91 -58.0 15.91 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.772 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -64.67 -36.35 83.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.089 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.4 ' CD2' ' CD1' ' A' ' 50' ' ' ILE . 13.8 mt -52.89 -55.02 26.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.831 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -54.48 -43.35 71.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.767 179.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.98 -45.78 61.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.788 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 13.4 p -100.98 8.42 8.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.342 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.536 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 60.1 mt -138.51 27.11 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.33 0.586 . . . . 0.0 111.034 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.46 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -85.78 15.91 4.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.803 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -127.65 144.27 50.53 Favored Pre-proline 0 C--O 1.23 0.072 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.427 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -48.7 -37.97 36.06 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.347 2.032 . . . . 0.0 111.513 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -69.38 -34.07 74.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.644 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.509 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -90.46 -12.45 37.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.79 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.48 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.8 mt -52.51 -45.86 95.5 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.9 Cg_exo -47.01 -23.92 2.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.735 2.29 . . . . 0.0 113.595 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.517 ' HB2' HG12 ' A' ' 50' ' ' ILE . 12.4 mt -73.73 -37.63 65.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.736 0.303 . . . . 0.0 111.322 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.419 ' CE2' ' HD2' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -60.06 -48.83 80.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.908 0.385 . . . . 0.0 111.111 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.402 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -75.22 -30.99 60.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.994 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.545 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.73 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.283 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -34.24 55.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.499 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -41.53 -63.12 0.89 Allowed Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.905 -178.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.499 ' CD ' ' HB3' ' A' ' 63' ' ' ARG . 87.0 Cg_exo -33.8 -33.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.338 2.692 . . . . 0.0 113.541 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.432 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.5 mt -64.91 -53.81 40.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.355 0.598 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.436 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.8 OUTLIER -43.41 132.19 3.59 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.116 179.52 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.4 ' HG2' ' HB2' ' A' ' 70' ' ' HIS . 18.2 Cg_endo -59.86 165.5 10.02 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.618 2.212 . . . . 0.0 112.019 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 tt -51.99 -51.36 57.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.219 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -61.06 2.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 0.0 110.539 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.434 ' HB2' HG21 ' A' ' 66' ' ' ILE . 36.8 m170 -59.21 -23.66 62.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -43.43 86.94 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.116 0.484 . . . . 0.0 110.166 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.2 t -64.85 -45.51 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.374 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -32.98 70.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.473 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.45 ' CD1' ' CG1' ' A' ' 39' ' ' VAL . 7.5 t80 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.539 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 10.6 mt . . . . . 0 C--O 1.232 0.175 0 CA-C-O 121.027 0.442 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 9.5 tp -55.32 -52.66 62.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.597 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.406 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.5 OUTLIER -56.75 -33.41 66.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.05 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 22.9 t -68.69 -36.53 74.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.257 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.8 OUTLIER -63.5 -45.62 89.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 110.294 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.7 -35.8 81.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.623 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.8 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.908 0.385 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.45 -33.55 73.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.825 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.0 t -61.42 -36.86 75.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.207 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.04 -51.16 41.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.105 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 3.2 ttt180 -67.17 -26.84 66.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.156 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -72.7 -45.99 55.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.289 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.571 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.76 -43.92 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -44.92 84.82 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.768 178.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.444 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 4.2 m-70 -58.91 -39.31 81.13 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.202 0.525 . . . . 0.0 109.743 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -62.47 -38.1 88.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.282 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' ILE . 52.9 t -59.6 -48.21 88.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.512 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -57.59 -42.64 83.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.17 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -69.01 -33.56 73.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.617 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 69.5 mt -95.4 6.44 49.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.651 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.408 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 40.3 mm -147.12 68.35 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-O 121.657 0.741 . . . . 0.0 110.037 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.15 -35.75 67.51 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.921 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -63.46 174.89 1.14 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -109.3 -30.51 7.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.41 -51.88 66.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -50.88 -34.8 29.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.39 0.614 . . . . 0.0 109.42 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -72.4 -33.67 67.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.26 -43.08 95.97 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.147 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -64.56 -43.22 94.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.233 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.4 tp -59.09 -41.13 87.33 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.54 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -60.0 -47.92 83.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.76 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -59.09 -39.32 81.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.735 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.1 t -63.87 -49.65 80.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.737 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.4 mt -62.17 -40.71 96.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.365 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -60.27 -34.53 73.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.398 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.41 ' O ' ' N ' ' A' ' 36' ' ' THR . 4.2 mmt -66.08 -51.41 58.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.242 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.458 ' CD2' HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -53.53 -35.53 60.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.085 0.469 . . . . 0.0 110.543 179.419 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -55.64 5.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.84 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.69 -55.24 5.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.41 ' N ' ' O ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -82.74 -36.17 25.99 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.603 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.455 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.3 mmt 64.77 23.93 12.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.02 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.42 ' O ' HD12 ' A' ' 42' ' ' LEU . 29.4 t70 -100.59 114.74 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.333 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.5 t -73.01 -8.62 11.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.583 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.57 -34.26 60.67 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.072 0.463 . . . . 0.0 110.243 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.0 t -73.62 -33.85 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.417 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.458 HD11 ' CD2' ' A' ' 33' ' ' TYR . 0.5 OUTLIER -69.18 -42.63 75.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.831 179.901 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.7 t -58.06 -43.29 84.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.091 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.84 -56.17 15.95 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.78 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.08 -49.12 75.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.839 0.352 . . . . 0.0 111.203 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.415 ' O ' ' N ' ' A' ' 50' ' ' ILE . 68.5 mt -50.57 -48.0 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.086 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.77 -49.57 72.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.075 0.464 . . . . 0.0 110.634 179.776 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.85 -39.65 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.023 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.4 p -101.46 7.28 9.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.445 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.522 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 77.9 mt -143.15 28.06 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.257 0.551 . . . . 0.0 111.419 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.447 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.4 p30 -89.81 14.99 10.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.641 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -130.94 150.47 76.68 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.575 0.226 . . . . 0.0 110.607 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.1 -38.6 70.78 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.402 2.068 . . . . 0.0 111.447 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.32 -33.23 72.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.367 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.448 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 11.1 mtt85 -91.75 -5.88 52.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.573 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.494 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 14.6 mt -60.56 -44.8 96.58 Favored Pre-proline 0 CA--C 1.53 0.206 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.68 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 90.4 Cg_exo -43.48 -28.11 1.57 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.705 2.27 . . . . 0.0 113.421 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.522 ' HB2' HG12 ' A' ' 50' ' ' ILE . 16.0 mt -73.85 -33.91 64.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.902 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.28 -48.65 80.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.734 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.409 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.1 t0 -75.22 -31.0 60.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.651 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.71 -62.89 1.53 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.738 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.81 -31.78 53.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.724 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.469 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -37.15 -66.69 0.27 Allowed Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 112.327 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.475 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 76.8 Cg_exo -36.6 -32.39 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.092 2.528 . . . . 0.0 113.561 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.464 HD13 ' CE2' ' A' ' 9' ' ' PHE . 19.2 mt -65.67 -51.09 62.16 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.718 0.771 . . . . 0.0 109.439 179.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.433 HG21 ' CB ' ' A' ' 70' ' ' HIS . 1.9 mt -44.26 121.87 4.08 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.373 -1.285 . . . . 0.0 111.53 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.4 ' O ' ' N ' ' A' ' 71' ' ' GLN . 76.1 Cg_exo -47.84 165.75 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.832 2.355 . . . . 0.0 112.439 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.3 tt -55.51 -56.9 14.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.785 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -44.47 97.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.43 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.433 ' CB ' HG21 ' A' ' 66' ' ' ILE . 23.5 m170 -63.9 -29.3 70.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.288 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' A' ' 67' ' ' PRO . 1.4 mt-30 -61.51 -42.08 98.27 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.172 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.89 -46.26 89.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.09 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -65.01 -33.07 75.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.213 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.3 t80 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.512 179.641 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.9 mt . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.787 0.327 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 13.2 tp -54.45 -52.8 60.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.854 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 45.5 tttm -57.45 -31.52 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.835 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.98 -36.79 80.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.877 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 24.4 t -71.04 -37.19 66.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.8 OUTLIER -65.0 -45.57 85.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.006 0.431 . . . . 0.0 110.291 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -68.92 -34.63 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 179.716 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.827 0.346 . . . . 0.0 110.991 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.07 -40.3 89.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.947 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.7 t -60.45 -35.02 60.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.003 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.406 ' CB ' HG23 ' B' ' 104' ' ' VAL . . . -69.27 -50.95 42.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.182 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.64 -26.77 67.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -71.22 -48.98 48.11 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.04 -43.02 72.13 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.919 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -44.11 81.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.716 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 11.5 m170 -58.49 -42.68 88.13 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.2 -35.43 75.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.29 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 43.3 t -62.22 -49.03 85.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.616 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.63 -37.74 73.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.198 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -68.95 -30.11 68.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.456 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 mt -105.35 10.18 33.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.611 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.448 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.3 mm -146.26 67.96 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 CA-C-O 121.679 0.752 . . . . 0.0 110.151 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -79.12 -26.18 42.9 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.023 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.2 OUTLIER -49.2 -25.14 2.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.551 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 19' ' ' ASN . 5.8 t0 82.76 -53.14 0.19 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.097 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.57 -50.06 68.89 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -50.86 -34.59 28.67 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -35.7 76.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.953 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' HA ' ' CD2' ' A' ' 27' ' ' TYR . 1.0 OUTLIER -62.23 -47.37 84.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.014 0.435 . . . . 0.0 110.187 179.467 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -61.41 -39.33 90.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.328 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.3 -40.99 92.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.497 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.421 ' CD2' ' HA ' ' A' ' 24' ' ' ASP . 11.6 m-85 -60.87 -46.82 89.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.408 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.43 -37.03 82.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.766 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.29 -44.64 99.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.0 mt -64.77 -46.41 82.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.509 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -32.33 72.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.23 -45.72 72.48 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.454 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.446 ' CE2' HG13 ' A' ' 66' ' ' ILE . 4.3 t80 -59.47 -38.37 80.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.963 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -74.52 -44.9 49.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.826 0.346 . . . . 0.0 111.544 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -55.09 5.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 112.059 -179.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 p -74.71 -40.24 61.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.426 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.2 mtp 69.96 26.04 4.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.89 0.376 . . . . 0.0 110.7 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.46 124.66 53.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.645 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.6 t -77.33 -10.36 13.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.207 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.72 -35.41 44.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.964 0.411 . . . . 0.0 110.61 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 32.8 t -71.11 -34.3 54.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.236 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' ' CD1' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -70.0 -47.99 59.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.002 179.78 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.9 t -57.44 -40.41 74.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.788 0.328 . . . . 0.0 111.039 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.93 -56.25 17.42 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.698 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.43 -48.61 77.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.838 0.351 . . . . 0.0 111.13 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' A' ' 50' ' ' ILE . 0.6 OUTLIER -50.56 -46.93 57.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.147 -179.707 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.3 -52.33 64.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.792 179.81 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.92 -38.6 36.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.958 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.7 p -101.2 4.6 10.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.594 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.515 HG12 ' HB2' ' A' ' 58' ' ' LEU . 58.2 mt -138.46 27.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 121.267 0.555 . . . . 0.0 111.161 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.435 ' N ' ' O ' ' A' ' 47' ' ' LYS . 34.3 m-20 -85.49 12.81 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.748 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.75 142.82 43.23 Favored Pre-proline 0 C--N 1.334 -0.071 0 O-C-N 122.3 -0.25 . . . . 0.0 110.674 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -46.27 -38.87 20.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.288 1.992 . . . . 0.0 111.788 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -33.62 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.588 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.429 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 40.8 mtt180 -90.75 -11.43 39.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.727 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.497 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -54.31 -45.35 99.28 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 88.0 Cg_exo -45.87 -24.76 2.28 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.853 2.369 . . . . 0.0 113.667 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.515 ' HB2' HG12 ' A' ' 50' ' ' ILE . 9.3 mt -72.92 -35.83 67.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.698 0.285 . . . . 0.0 110.919 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -50.79 72.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.751 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.422 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 2.8 t0 -75.38 -31.26 60.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.809 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.506 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -60.9 -56.25 23.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.849 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.17 -32.54 58.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 111.559 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.439 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.5 mtp180 -37.37 -63.72 0.47 Allowed Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.473 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.439 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 74.9 Cg_exo -36.9 -32.64 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.127 2.552 . . . . 0.0 113.617 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.487 HD12 ' CE2' ' A' ' 9' ' ' PHE . 14.1 mt -65.53 -50.75 64.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.624 0.726 . . . . 0.0 109.79 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -46.62 133.07 8.14 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.242 179.754 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -49.6 165.6 0.26 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.64 2.226 . . . . 0.0 112.284 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -57.87 10.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.855 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -50.02 75.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.039 0.447 . . . . 0.0 110.303 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.419 ' CB ' HG23 ' A' ' 66' ' ' ILE . 53.0 m170 -60.7 -27.59 68.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.374 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -65.35 -44.21 88.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.9 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 19.9 t -61.45 -43.54 96.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.326 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -66.51 -47.06 74.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.383 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.7 t80 . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.443 179.547 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 49.6 mt . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.759 0.314 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.421 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -54.03 -35.18 61.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.128 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -33.19 73.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.95 -38.23 76.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.406 HG23 ' CB ' ' A' ' 6' ' ' ALA . 39.0 t -71.01 -51.0 38.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.371 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 pp -61.57 -33.48 73.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.573 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -73.79 -38.77 64.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 0.0 110.257 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.591 179.501 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.756 0.312 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.95 -33.68 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.829 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.43 -35.92 74.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.22 -50.89 35.27 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.964 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -26.81 68.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.155 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -70.97 -48.98 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.357 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.535 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.04 -43.59 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.084 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -57.1 -44.94 83.7 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.712 178.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -57.83 -40.04 79.1 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.792 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.7 mtpt -62.82 -36.8 84.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.029 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 17' ' ' ILE . 46.5 t -58.59 -48.99 84.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.285 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -57.58 -42.25 82.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.081 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -69.1 -34.62 75.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.523 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.3 mt -95.12 7.34 46.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.595 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.412 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 40.0 mm -148.27 68.69 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.73 0.776 . . . . 0.0 110.129 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -57.16 -36.13 70.38 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.97 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -64.55 169.18 5.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.695 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -102.54 -31.46 10.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.95 67.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.933 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -50.77 -34.69 28.29 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.425 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 27.7 mttt -72.71 -35.19 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.939 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -62.86 -41.11 99.24 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.132 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.92 -45.75 80.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.298 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.36 -39.56 87.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.703 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.0 m-85 -61.82 -44.06 97.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.701 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -65.56 -40.98 93.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.648 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.82 -53.25 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.063 0.459 . . . . 0.0 110.982 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.98 -36.19 76.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.657 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -43.14 84.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.569 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -45.06 94.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.046 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.473 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 6.6 t80 -57.65 -48.17 80.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.781 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -74.99 -33.66 61.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.873 0.368 . . . . 0.0 111.664 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -77.44 -54.98 5.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.7 p -93.98 -6.0 46.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.467 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.5 mmt 58.87 23.5 11.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.708 0.29 . . . . 0.0 110.96 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -98.22 116.72 31.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.915 0.388 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.8 t -82.52 -20.7 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.27 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.64 -28.1 55.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.804 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.0 t -73.46 -43.77 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.779 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.473 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 2.5 pp -68.53 -39.21 81.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.753 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.425 HG22 ' CD2' ' A' ' 74' ' ' TYR . 84.9 t -60.65 -40.71 85.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.853 0.358 . . . . 0.0 110.389 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.51 -59.13 9.23 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.26 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -60.1 -44.2 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 110.771 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' A' ' 50' ' ' ILE . 12.7 mt -51.3 -44.13 61.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.73 -48.31 78.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.105 0.479 . . . . 0.0 110.627 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 mt -54.17 -37.53 64.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.824 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.9 p -101.04 5.13 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.428 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.546 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 65.7 mt -142.33 29.08 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-O 121.301 0.572 . . . . 0.0 110.72 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.7 p-10 -88.07 15.2 7.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.945 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.2 pt-20 -131.69 149.12 72.54 Favored Pre-proline 0 C--N 1.334 -0.098 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.765 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_endo -49.51 -38.51 44.47 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.697 2.265 . . . . 0.0 111.812 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.2 t -69.12 -33.93 74.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.609 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.513 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 97.9 mtt180 -94.5 -5.28 46.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.685 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.487 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 12.2 mt -59.44 -45.24 98.91 Favored Pre-proline 0 CA--C 1.532 0.284 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 81.4 Cg_exo -42.94 -29.03 1.38 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.772 2.315 . . . . 0.0 113.475 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HB2' HG12 ' A' ' 50' ' ' ILE . 14.4 mt -73.94 -32.29 63.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.741 0.305 . . . . 0.0 111.023 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.426 ' CD1' HG23 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -60.83 -50.02 75.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.095 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.407 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 22.5 t0 -75.21 -31.02 60.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.894 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.532 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.73 -60.26 4.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.95 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.3 -36.99 66.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.928 -179.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.475 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -36.32 -66.8 0.25 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.479 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.486 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 79.7 Cg_exo -36.14 -33.04 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.191 2.594 . . . . 0.0 113.342 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.448 HD13 ' CE2' ' A' ' 9' ' ' PHE . 22.7 mt -65.07 -51.93 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.0 109.875 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.416 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.7 OUTLIER -47.22 136.73 8.74 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.032 179.622 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.25 165.61 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.483 2.122 . . . . 0.0 112.34 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 tp -57.09 -57.87 10.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.955 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -51.41 69.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.106 0.479 . . . . 0.0 110.345 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.401 ' CB ' HG23 ' A' ' 66' ' ' ILE . 31.5 m170 -59.91 -28.31 67.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.325 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.32 -44.31 95.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.086 0.469 . . . . 0.0 110.155 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.32 -47.35 93.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.345 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.45 -39.38 93.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.356 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.425 ' CD2' HG22 ' A' ' 43' ' ' VAL . 57.6 t80 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.691 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.0 mt . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.824 0.345 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.444 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 13.9 tp -55.1 -52.86 61.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.093 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.6 -37.57 68.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.92 -36.54 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.719 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 2.1 t -71.09 -34.09 53.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.078 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -70.87 -45.72 63.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.973 0.416 . . . . 0.0 110.365 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.0 -39.74 87.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.903 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.753 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.784 0.326 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -65.58 -36.81 84.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.753 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.2 -35.13 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.912 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.409 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -67.63 -51.15 53.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.271 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.427 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -64.41 -26.95 68.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.245 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.8 -49.08 50.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.538 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -68.83 -43.29 75.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.428 ' HG3' ' CG1' ' B' ' 104' ' ' VAL . 0.7 OUTLIER -61.96 -40.23 94.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.881 178.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.427 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 8.2 m170 -56.99 -41.37 78.28 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -60.96 -36.11 78.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.795 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ILE . 50.1 t -58.82 -48.7 85.38 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.105 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.17 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.7 -39.22 76.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.119 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -68.78 -31.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.465 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.3 mt -102.29 8.94 40.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.44 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.442 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 31.3 mm -149.97 69.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 CA-C-O 121.677 0.751 . . . . 0.0 110.025 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -58.96 -33.84 71.11 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.899 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -63.46 160.8 15.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.801 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -97.64 -30.76 12.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.978 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.15 -52.95 61.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.007 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -50.95 -34.78 30.22 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.2 mttt -72.82 -34.3 66.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.766 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -61.77 -43.03 99.65 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.55 -45.54 83.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.289 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.7 tt -60.81 -40.81 94.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.455 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -59.26 -43.42 92.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -69.54 -37.34 77.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.813 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.7 t -62.36 -52.33 61.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.876 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.2 mt -60.9 -41.12 95.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.667 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -40.22 87.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.268 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -45.62 87.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.971 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.47 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 4.9 t80 -55.58 -44.67 77.1 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.941 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -74.87 -34.42 62.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.556 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.47 -55.06 5.7 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.0 p -88.07 -14.62 38.43 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.443 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.8 mmt 61.37 23.6 13.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.739 0.304 . . . . 0.0 110.626 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -98.48 116.72 31.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.744 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.433 HG23 ' CG ' ' A' ' 70' ' ' HIS . 21.4 t -81.27 -20.77 10.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.281 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.09 -29.27 48.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.339 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.2 t -73.42 -42.88 56.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.79 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.47 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 2.1 pp -70.2 -39.73 75.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.744 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 81.6 t -65.01 -37.36 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.938 0.399 . . . . 0.0 110.388 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.34 -56.68 18.59 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.137 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -64.72 -44.69 89.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.857 0.36 . . . . 0.0 110.774 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.413 ' O ' ' N ' ' A' ' 50' ' ' ILE . 13.7 mt -50.97 -41.07 59.15 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.688 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.48 -46.62 89.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.398 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.68 -34.49 65.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.563 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.4 p -100.92 0.3 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.3 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.548 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 50.8 mt -138.5 29.31 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.334 0.587 . . . . 0.0 110.939 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.483 ' N ' ' O ' ' A' ' 47' ' ' LYS . 20.7 p30 -87.53 16.77 5.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.787 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.7 mm-40 -127.35 143.57 47.7 Favored Pre-proline 0 C--N 1.334 -0.091 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.443 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -47.83 -38.47 30.37 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.452 2.101 . . . . 0.0 111.518 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.33 -33.8 73.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.713 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.523 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 1.8 mtt180 -92.04 -10.32 39.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.885 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.493 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.9 mt -55.62 -44.7 99.79 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.733 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.3 Cg_exo -44.31 -26.77 1.73 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.661 2.24 . . . . 0.0 113.474 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.477 ' HB2' HG12 ' A' ' 50' ' ' ILE . 3.7 mt -73.69 -32.0 63.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.842 0.353 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.54 -40.78 85.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.81 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 18.2 t70 -75.37 -31.0 60.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.811 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.486 ' HB2' ' CD1' ' A' ' 9' ' ' PHE . . . -68.63 -56.84 6.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.864 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.27 -38.16 79.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.86 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.444 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -39.69 -65.14 0.45 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.258 -179.002 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 70.6 Cg_exo -35.59 -32.91 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.261 2.641 . . . . 0.0 113.483 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.444 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.6 mt -65.07 -53.72 41.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 109.822 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.4 HG22 ' CB ' ' A' ' 70' ' ' HIS . 1.5 mp -42.26 128.15 2.8 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.306 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.79 165.69 1.09 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.791 2.328 . . . . 0.0 112.347 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -52.47 -53.6 43.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.031 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.51 -54.65 44.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.682 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.433 ' CG ' HG23 ' A' ' 39' ' ' VAL . 27.2 m170 -63.11 -20.44 65.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.555 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -53.91 32.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.967 0.413 . . . . 0.0 110.244 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.424 HG12 ' N ' ' A' ' 73' ' ' GLU . 6.1 p -61.91 -37.17 77.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.161 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.424 ' N ' HG12 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -70.68 -38.12 73.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.065 179.237 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.6 t80 . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.468 179.416 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.74 0.305 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.413 HD21 ' CE2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -54.21 -40.55 67.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.993 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.84 -31.99 72.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.86 -34.9 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.053 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.428 ' CG1' ' HG3' ' A' ' 10' ' ' ARG . 25.2 t -70.85 -55.19 14.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.342 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 2.8 pp -58.6 -40.98 84.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.803 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -73.7 -33.42 64.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.804 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.039 -179.992 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 120.678 0.275 . . . . 0.0 111.652 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.6 tttp -58.69 -33.4 70.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.9 0.381 . . . . 0.0 110.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 51.6 t -59.89 -38.66 77.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.425 ' CB ' HG23 ' B' ' 104' ' ' VAL . . . -67.71 -51.04 54.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.27 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -67.04 -26.88 66.97 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.108 179.392 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -72.64 -48.84 36.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.388 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.546 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -68.44 -42.86 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -58.26 -46.12 86.57 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.095 178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.7 t-160 -56.54 -42.05 77.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -60.75 -35.92 77.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.292 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.5 t -60.67 -49.84 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.601 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -57.75 -39.34 77.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.501 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -69.12 -30.12 68.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.735 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.4 mt -96.43 -0.22 49.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.621 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.427 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 91.4 mt -143.95 69.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 CA-C-O 122.122 0.963 . . . . 0.0 110.374 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -76.07 -2.81 32.63 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.88 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -71.66 -23.54 61.69 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 t0 78.55 -55.83 0.47 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.19 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -51.91 57.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.857 0.36 . . . . 0.0 111.245 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -50.88 -34.75 29.52 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -71.02 -34.46 71.32 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.89 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -45.09 96.06 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.114 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -64.57 -41.39 96.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.149 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -36.57 79.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.533 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -64.6 -47.38 78.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.612 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.4 -37.22 86.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.594 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.8 t -69.34 -36.39 71.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.608 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.0 mt -68.53 -43.95 75.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.54 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -36.75 84.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.382 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -48.23 77.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.202 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.48 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 6.1 t80 -55.51 -43.06 75.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.992 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -74.78 -38.45 62.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.782 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -55.08 5.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.2 p -82.9 -13.81 55.38 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.427 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 20.5 mmt 60.45 21.18 10.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.768 0.318 . . . . 0.0 110.929 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.52 113.11 24.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.42 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 25.8 t -82.12 -23.32 9.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.225 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.82 -28.8 58.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.986 0.422 . . . . 0.0 110.915 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.8 t -73.42 -43.93 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.841 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.48 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -69.23 -37.04 77.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.678 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 71.7 t -62.09 -46.38 96.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.955 0.407 . . . . 0.0 110.144 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -58.42 -56.63 24.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.995 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -60.6 -36.94 79.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 110.447 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 50' ' ' ILE . 10.4 mt -52.45 -46.21 66.35 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.523 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.8 mptt -55.42 -46.38 76.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.543 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -54.41 -39.47 67.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.641 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.4 p -101.13 8.61 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.272 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.517 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 88.3 mt -144.79 28.68 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 121.305 0.574 . . . . 0.0 110.666 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' ' O ' ' A' ' 47' ' ' LYS . 21.9 p-10 -86.21 10.35 14.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.219 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -133.4 155.97 80.21 Favored Pre-proline 0 C--N 1.334 -0.084 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.249 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.29 -38.84 73.21 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.824 2.349 . . . . 0.0 112.086 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.75 -34.18 75.15 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.461 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.453 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 87.1 mtt180 -94.49 -1.21 53.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.743 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.49 ' HA ' HG21 ' A' ' 50' ' ' ILE . 11.9 mt -64.73 -47.41 75.45 Favored Pre-proline 0 CA--C 1.53 0.203 0 CA-C-O 120.605 0.24 . . . . 0.0 111.644 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.52 -26.81 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.732 2.288 . . . . 0.0 113.605 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.458 ' HB2' HG12 ' A' ' 50' ' ' ILE . 20.8 mt -69.71 -34.84 74.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.725 0.298 . . . . 0.0 111.242 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.4 ' CD2' ' OH ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -56.52 -48.38 77.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.01 0.433 . . . . 0.0 110.887 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.474 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.0 p-10 -75.28 -31.01 60.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.867 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.449 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.69 -56.96 14.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.996 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -37.64 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.458 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.574 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 11.6 ttm-85 -37.37 -59.88 0.96 Allowed Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 90.8 Cg_exo -38.24 -37.14 0.6 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.86 2.373 . . . . 0.0 113.094 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.465 HD11 ' CZ ' ' A' ' 9' ' ' PHE . 12.3 mt -65.2 -54.11 34.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.369 0.604 . . . . 0.0 110.047 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -44.31 129.02 4.67 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.148 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.62 165.27 0.43 Allowed 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.63 2.22 . . . . 0.0 112.424 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.435 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.0 OUTLIER -56.16 -49.21 74.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.296 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -46.62 81.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.137 0.494 . . . . 0.0 110.418 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.415 ' ND1' ' CG2' ' A' ' 39' ' ' VAL . 29.2 m170 -64.95 -30.2 71.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.459 ' HG3' ' N ' ' A' ' 72' ' ' VAL . 0.0 OUTLIER -70.85 -32.28 69.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 0.0 110.298 179.547 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.459 ' N ' ' HG3' ' A' ' 71' ' ' GLN . 29.4 t -67.9 -46.2 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.061 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -69.18 -38.49 78.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.227 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.418 ' CD2' HG23 ' A' ' 43' ' ' VAL . 11.3 t80 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.335 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 65.6 mt . . . . . 0 N--CA 1.463 0.181 0 CA-C-O 120.553 0.216 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.416 ' HA ' HD12 ' A' ' 65' ' ' LEU . 8.6 tp -51.63 -52.64 46.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.827 0.346 . . . . 0.0 110.984 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -31.5 65.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.674 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -69.86 -32.58 71.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.425 HG23 ' CB ' ' A' ' 6' ' ' ALA . 1.6 t -71.04 -43.27 76.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.668 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.67 -45.59 82.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.258 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.52 -33.64 73.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.63 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--N 1.33 -0.269 0 CA-C-O 121.024 0.44 . . . . 0.0 110.899 179.837 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 . . . . . 0 N--CA 1.465 0.323 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -59.02 -33.38 70.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.754 0.311 . . . . 0.0 110.763 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -56.95 -38.61 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.012 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.411 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -67.33 -50.93 58.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.071 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -26.92 68.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.238 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -49.15 51.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.626 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.518 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.18 -43.19 74.72 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.802 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -45.2 82.7 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.907 178.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -57.69 -41.82 82.42 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.117 0.484 . . . . 0.0 109.852 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -60.14 -35.98 76.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.001 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.0 t -61.21 -47.7 92.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.32 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -57.6 -39.03 75.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.149 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -69.0 -34.66 75.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.429 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 69.5 mt -95.88 6.28 49.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.508 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 39.2 mm -148.08 69.03 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-O 121.708 0.766 . . . . 0.0 110.081 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.56 -33.51 66.21 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.016 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.82 164.26 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.771 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -98.82 -32.7 11.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.942 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.93 63.16 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.953 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -50.87 -34.69 29.16 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 19.3 mttt -73.29 -34.77 65.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.947 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.73 -40.57 97.07 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.14 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.17 -43.65 81.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.2 tp -61.5 -38.11 86.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.647 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.438 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 20.5 m-85 -63.22 -46.3 87.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.664 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -38.07 88.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.626 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 t -62.24 -47.09 94.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.868 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.39 -44.79 90.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.496 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -65.4 -35.09 79.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.415 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.34 -44.71 74.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.442 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.459 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 8.9 t80 -61.08 -36.07 78.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.115 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -74.43 -41.0 61.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.581 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -77.43 -52.51 9.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.987 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.7 p -79.38 -21.93 45.04 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.8 mmt 60.66 22.39 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.672 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -104.13 119.77 39.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.776 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.432 HG22 ' CE1' ' A' ' 33' ' ' TYR . 21.9 t -79.14 -18.29 13.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.237 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.16 -29.63 48.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -73.47 -44.41 54.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.662 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.459 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 1.2 pp -68.98 -38.31 79.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.767 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 70.8 t -66.82 -37.32 79.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.917 0.389 . . . . 0.0 110.422 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.4 -57.96 14.47 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.68 -0.772 . . . . 0.0 111.894 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.69 -41.7 99.25 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.945 0.403 . . . . 0.0 110.634 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' A' ' 50' ' ' ILE . 11.2 mt -52.19 -40.17 61.15 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.622 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -59.92 -46.61 88.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.386 179.468 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 mt -55.53 -36.72 67.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.485 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.6 p -101.13 4.53 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.394 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.545 HG12 ' HB2' ' A' ' 58' ' ' LEU . 73.9 mt -142.52 29.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.26 0.552 . . . . 0.0 110.997 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.486 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.3 p30 -87.51 16.72 5.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.917 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.404 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 5.0 mm-40 -129.54 142.54 45.63 Favored Pre-proline 0 C--N 1.333 -0.11 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.65 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.69 -39.01 17.83 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.205 1.936 . . . . 0.0 111.835 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 t -69.25 -35.14 75.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.698 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.487 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 0.1 OUTLIER -89.96 -10.5 44.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.74 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.47 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 14.1 mt -53.08 -46.11 97.86 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 95.6 Cg_exo -44.17 -26.57 1.56 Allowed 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.727 2.285 . . . . 0.0 113.67 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.545 ' HB2' HG12 ' A' ' 50' ' ' ILE . 26.5 mt -73.67 -30.25 62.79 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.064 -0.254 . . . . 0.0 111.114 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -44.35 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.987 0.422 . . . . 0.0 110.704 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.31 -31.42 60.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.848 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.471 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.66 -57.32 10.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.656 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -31.46 53.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.514 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.46 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 2.7 ttp180 -40.04 -59.58 1.75 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.5 Cg_endo -48.81 -26.1 9.27 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.801 2.334 . . . . 0.0 113.348 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.465 HD12 ' CE2' ' A' ' 9' ' ' PHE . 21.0 mt -65.01 -54.54 28.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.35 0.595 . . . . 0.0 109.694 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.436 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.1 mp -42.07 136.03 2.26 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.425 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.428 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 54.2 Cg_exo -52.24 165.79 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.807 2.338 . . . . 0.0 112.46 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.3 -55.96 25.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.16 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -50.24 74.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.419 . . . . 0.0 110.435 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.415 ' CB ' HG22 ' A' ' 66' ' ' ILE . 26.8 m170 -61.73 -28.24 69.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.178 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.77 -43.72 98.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.92 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.3 t -62.31 -45.22 99.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.96 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.04 -30.75 71.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.672 179.703 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.893 0.378 . . . . 0.0 110.927 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.436 ' CD1' ' CD2' ' A' ' 33' ' ' TYR . 0.3 OUTLIER -56.46 -36.75 69.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.928 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 3.8 tttt -68.54 -32.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.819 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.96 -37.31 75.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.082 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.417 HG21 HD13 ' A' ' 65' ' ' LEU . 33.2 t -69.58 -54.54 19.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.518 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 2.4 pp -57.34 -39.8 76.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.677 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.01 -34.86 66.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.342 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.622 179.553 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.784 0.326 . . . . 0.0 110.883 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -59.61 -39.22 83.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.4 t -61.13 -35.06 63.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.882 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.423 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -69.02 -51.18 41.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.236 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.426 ' HA ' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -67.64 -26.87 66.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.25 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -73.18 -46.06 52.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.552 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.92 -44.74 65.56 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.47 ' HG3' ' N ' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -63.89 -35.99 82.48 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 179.259 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.47 ' N ' ' HG3' ' A' ' 10' ' ' ARG . 20.5 t-160 -62.32 -42.66 99.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -61.1 -35.91 78.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.82 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' ILE . 64.0 t -62.84 -44.85 99.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.306 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.48 -42.21 82.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.958 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -69.15 -37.17 78.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.267 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.3 mt -89.9 6.06 43.61 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.417 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.413 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.4 mm -145.91 67.98 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 CA-C-O 121.743 0.782 . . . . 0.0 110.208 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.41 -31.26 67.55 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.917 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -73.32 122.27 21.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -62.88 -27.55 69.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.106 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.34 -52.02 63.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.899 0.38 . . . . 0.0 111.079 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -50.8 -34.59 28.14 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -71.72 -34.7 69.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.815 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.63 97.55 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.13 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.4 -44.71 86.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.333 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.44 -41.75 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.539 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -59.62 -43.25 93.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.523 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.65 -35.99 82.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.459 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.401 ' CG1' ' CD2' ' A' ' 42' ' ' LEU . 24.4 t -65.6 -44.98 93.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.2 mt -63.85 -44.4 93.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.489 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.6 mtp180 -59.73 -34.06 72.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.21 -52.12 56.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.495 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.54 ' O ' ' HA ' ' A' ' 37' ' ' MET . 6.3 t80 -55.98 -34.36 65.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.123 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -74.84 -43.95 51.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.805 0.336 . . . . 0.0 111.109 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.74 -54.91 5.8 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 p -84.42 -33.08 23.79 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.54 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.2 mmt 63.77 39.28 8.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.987 0.422 . . . . 0.0 110.665 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -113.71 125.21 53.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.73 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 17.2 t -75.76 -14.0 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.988 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.71 -38.94 37.8 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.996 0.427 . . . . 0.0 110.215 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.8 t -69.41 -34.04 60.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.88 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.432 HD11 ' CD1' ' A' ' 33' ' ' TYR . 1.7 mt -66.55 -50.71 62.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.549 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.1 t -61.61 -38.13 79.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.29 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.61 -56.65 23.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.821 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -72.95 -41.32 64.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.74 0.305 . . . . 0.0 111.341 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.444 ' HB3' ' CE1' ' A' ' 59' ' ' PHE . 30.5 mt -50.33 -45.19 54.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.949 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -61.78 -46.72 88.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.699 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.6 mt -50.83 -37.69 44.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.064 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 p -101.04 -6.55 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.491 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.636 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 7.4 mt -129.3 31.0 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.105 0.479 . . . . 0.0 111.303 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.474 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.3 p30 -86.68 16.2 4.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.743 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -127.33 141.21 40.14 Favored Pre-proline 0 C--N 1.334 -0.1 0 C-N-CA 120.986 -0.285 . . . . 0.0 110.659 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.15 -38.49 19.58 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.267 1.978 . . . . 0.0 111.678 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.5 p -69.36 -34.77 75.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.492 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.636 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -88.4 -13.91 39.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.589 -179.72 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.65 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 17.1 mt -50.34 -50.71 69.37 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.65 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 4.3 Cg_exo -40.06 -28.83 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.291 2.661 . . . . 0.0 113.754 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.623 ' HB2' HG12 ' A' ' 50' ' ' ILE . 7.5 mt -65.69 -32.04 73.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.767 0.318 . . . . 0.0 111.002 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.444 ' CE1' ' HB3' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -60.88 -40.65 93.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.319 179.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.408 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -75.13 -31.36 61.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.481 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.459 ' CB ' ' CD1' ' A' ' 9' ' ' PHE . . . -65.12 -57.91 7.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.198 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.418 HG13 ' CD1' ' A' ' 65' ' ' LEU . 0.1 OUTLIER -65.35 -35.58 75.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.749 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.456 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 7.8 ttp180 -38.55 -58.25 1.65 Allowed Pre-proline 0 N--CA 1.468 0.44 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 9.5 Cg_endo -51.92 -28.42 31.52 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.597 2.198 . . . . 0.0 112.869 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.476 HD11 HG22 ' B' ' 104' ' ' VAL . 20.4 mt -65.2 -44.5 88.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.673 0.749 . . . . 0.0 109.371 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.431 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -62.54 130.08 93.18 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.643 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -51.86 165.46 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.566 2.177 . . . . 0.0 112.218 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -55.55 30.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.075 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmtt -57.36 -54.2 49.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.034 0.445 . . . . 0.0 110.417 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -59.6 -28.32 67.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.454 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -61.72 -44.07 97.62 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 30.7 t -65.2 -45.06 94.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.275 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.11 -27.04 67.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.444 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 56.7 t80 . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.517 179.746 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 7.9 mt . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.845 0.355 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.456 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.1 OUTLIER -53.5 -52.57 59.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 179.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.417 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -55.42 -32.74 62.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -39.27 85.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.476 HG22 HD11 ' A' ' 65' ' ' LEU . 21.7 t -71.03 -31.46 45.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.285 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.6 OUTLIER -68.53 -45.67 71.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.905 0.383 . . . . 0.0 110.3 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -69.4 -34.01 73.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.564 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.638 179.753 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.807 0.337 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -39.08 81.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.056 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.92 -40.66 63.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.213 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.07 -50.85 62.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 9.3 mtp180 -65.09 -26.72 68.34 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.01 -49.11 48.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.754 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.71 -41.61 71.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.071 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.17 92.53 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.818 178.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 12.3 m170 -59.29 -41.16 88.3 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 179.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -61.49 -34.52 75.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.171 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.412 ' O ' ' N ' ' A' ' 17' ' ' ILE . 47.8 t -62.13 -48.58 87.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -57.51 -40.18 78.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.175 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -69.06 -32.91 72.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.388 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -98.54 8.29 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.466 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.453 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 35.2 mm -147.68 68.56 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-O 121.721 0.772 . . . . 0.0 110.287 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -81.33 -8.82 59.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.274 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -66.93 -13.28 61.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.539 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.8 -61.61 0.49 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.609 0.242 . . . . 0.0 110.921 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.66 -48.73 66.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.916 0.388 . . . . 0.0 110.834 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -50.99 -34.45 29.13 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.78 -35.97 75.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.074 179.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.43 -44.61 86.8 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.998 0.428 . . . . 0.0 110.397 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -60.84 -44.17 97.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.587 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.29 -40.84 87.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.734 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -61.93 -41.43 97.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.768 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.36 -36.19 82.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.581 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.76 -36.63 70.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.835 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -70.24 -43.59 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.652 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.5 ttt85 -66.81 -35.45 80.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.485 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 23.7 tpp -69.14 -43.76 73.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.397 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.463 ' CD1' HD21 ' A' ' 42' ' ' LEU . 6.3 t80 -62.13 -39.64 93.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.905 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -74.86 -41.38 59.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.399 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -54.99 5.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.855 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 p -76.53 -23.14 53.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.84 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.431 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.5 mmt 63.64 18.38 11.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.771 0.319 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -97.87 116.6 30.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.757 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.5 t -79.41 -21.41 12.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.203 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.33 -30.81 54.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.877 0.37 . . . . 0.0 110.697 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.8 t -73.55 -41.88 55.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.677 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.463 HD21 ' CD1' ' A' ' 33' ' ' TYR . 0.7 OUTLIER -69.75 -38.09 76.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.696 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 76.4 t -65.87 -37.21 79.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 CA-C-O 120.961 0.41 . . . . 0.0 110.212 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.04 -57.98 13.65 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.962 179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -60.92 -44.37 97.28 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.021 0.438 . . . . 0.0 110.472 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 50' ' ' ILE . 10.7 mt -51.02 -40.73 58.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.3 OUTLIER -59.34 -50.24 74.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.271 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mp -51.45 -37.25 47.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.811 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.9 p -101.0 3.7 10.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.435 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.511 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 71.3 mt -140.4 29.64 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' A' ' 47' ' ' LYS . 27.0 m-20 -84.32 11.19 8.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.871 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -127.3 148.76 67.53 Favored Pre-proline 0 C--O 1.231 0.103 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.807 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.406 ' HA ' ' CD1' ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.69 -37.8 65.0 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.45 2.1 . . . . 0.0 111.445 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.29 -32.49 71.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.296 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.451 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 1.9 mtp180 -91.31 -9.22 45.81 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.391 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.5 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 18.1 mt -57.01 -44.55 99.83 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.718 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.17 -27.34 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.689 2.26 . . . . 0.0 113.577 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HB2' HG12 ' A' ' 50' ' ' ILE . 15.8 mt -70.51 -30.27 66.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.692 0.282 . . . . 0.0 111.037 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.378 . . . . 0.0 110.637 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -75.48 -31.27 60.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.805 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.435 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -65.57 -64.49 0.85 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.453 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.408 ' CG1' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -62.7 -28.32 44.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.423 ' HG2' ' CE2' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -41.72 -63.96 0.75 Allowed Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -178.857 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.415 ' HG2' ' O ' ' A' ' 61' ' ' ALA . 2.4 Cg_endo -46.25 -26.98 4.26 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.963 2.442 . . . . 0.0 113.214 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.475 HD11 ' CZ ' ' A' ' 9' ' ' PHE . 16.1 mt -65.41 -51.86 57.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 109.542 179.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.421 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.0 OUTLIER -47.68 129.89 11.05 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.7 -1.137 . . . . 0.0 111.156 179.458 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.408 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 53.7 Cg_exo -52.86 165.8 1.08 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.693 2.262 . . . . 0.0 112.418 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.9 mt -54.94 -56.85 15.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.135 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -54.6 44.58 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.249 0.547 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.421 ' CB ' HG23 ' A' ' 66' ' ' ILE . 20.1 m170 -57.54 -29.35 64.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.219 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.74 -44.26 96.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.846 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -59.29 -46.68 92.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.824 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.47 -31.13 71.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.99 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.423 ' CE2' ' HG2' ' A' ' 63' ' ' ARG . 2.3 t80 . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.354 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 17.5 mt . . . . . 0 N--CA 1.463 0.2 0 CA-C-O 120.663 0.268 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.412 HD23 ' CE2' ' A' ' 33' ' ' TYR . 1.8 pp -51.59 -40.58 60.09 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.764 0.316 . . . . 0.0 110.871 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -33.84 74.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.329 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.04 -32.43 70.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.569 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 2.0 t -68.78 -39.92 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.48 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.5 OUTLIER -65.12 -45.64 84.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.334 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -33.83 73.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.616 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.735 179.818 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.816 0.341 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.52 71.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.3 t -57.78 -38.34 64.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.26 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.1 -50.94 51.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.15 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -26.7 67.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.174 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.19 -48.27 52.55 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.461 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.509 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.77 -43.2 69.27 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -58.05 -42.18 84.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.696 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.04 -44.65 94.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.436 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -61.58 -32.56 72.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.215 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.414 HG23 ' CD2' ' A' ' 58' ' ' LEU . 49.0 t -62.32 -49.37 84.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.123 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -57.65 -37.94 74.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.851 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.92 -41.81 77.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.336 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.4 mt -87.42 4.89 41.42 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.357 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.421 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 41.6 mm -143.0 67.07 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-O 121.785 0.802 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -54.41 -31.25 54.7 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.975 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -73.13 164.64 26.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.619 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.32 -28.68 13.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.991 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.54 -51.64 67.74 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.401 ' CB ' HG21 ' A' ' 17' ' ' ILE . 27.4 mt-10 -50.9 -34.77 29.79 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 17.9 mttt -71.53 -34.9 70.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.966 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.97 -42.87 99.18 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -40.5 83.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.22 -46.03 92.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.63 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 15.4 m-30 -60.51 -42.65 96.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.729 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.73 -37.68 88.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.709 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.6 t -63.62 -51.82 65.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -60.56 -37.87 82.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.606 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.2 mmt-85 -65.23 -41.24 94.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.383 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.9 mmt -64.09 -46.83 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.462 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.466 ' CD1' HD21 ' A' ' 42' ' ' LEU . 13.0 t80 -59.59 -37.79 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.043 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -74.71 -44.76 48.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.563 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -55.15 5.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.151 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -75.21 -20.78 59.09 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.409 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 1.3 mmt 61.11 20.15 10.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.68 0.276 . . . . 0.0 110.7 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -104.73 120.68 41.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.91 0.386 . . . . 0.0 110.864 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.42 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 44.5 t -79.67 -16.61 13.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.21 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.51 -28.45 56.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.879 0.371 . . . . 0.0 110.947 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.2 t -73.18 -45.25 54.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.751 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.466 HD21 ' CD1' ' A' ' 33' ' ' TYR . 2.4 pp -67.92 -38.6 83.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.751 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 71.2 t -61.03 -38.99 80.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.003 0.43 . . . . 0.0 110.372 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.71 -59.19 8.47 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.157 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -60.53 -45.03 95.33 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.781 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 59' ' ' PHE . 12.9 mt -50.81 -44.48 59.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.2 tppt? -57.91 -46.61 84.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.567 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.09 -37.64 64.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.736 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 p -100.97 2.87 10.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.468 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.571 HG12 ' HB2' ' A' ' 58' ' ' LEU . 53.2 mt -139.13 29.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.406 0.622 . . . . 0.0 110.955 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.478 ' N ' ' O ' ' A' ' 47' ' ' LYS . 28.6 p30 -86.28 17.65 3.59 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.873 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.416 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 24.2 mm-40 -126.03 141.22 38.94 Favored Pre-proline 0 N--CA 1.458 -0.05 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.439 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -45.42 -38.9 16.24 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.157 1.905 . . . . 0.0 111.884 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.2 t -69.4 -36.03 76.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.851 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.516 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 61.0 mtt85 -87.82 -15.73 36.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.768 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.644 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 15.8 mt -46.54 -51.92 33.35 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.644 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.0 Cg_exo -39.13 -29.17 0.18 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.358 2.706 . . . . 0.0 113.739 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HB2' HG12 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -60.61 -30.14 69.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.821 0.344 . . . . 0.0 111.041 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.429 ' CE1' ' HB3' ' A' ' 46' ' ' LEU . 2.0 m-85 -69.61 -40.32 76.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 7.1 m-20 -75.28 -31.07 60.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.937 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.486 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -68.93 -61.85 1.63 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.047 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.34 -36.17 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.968 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.434 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 17.9 ttp180 -41.35 -66.68 0.37 Allowed Pre-proline 0 CA--C 1.538 0.487 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.11 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 88.9 Cg_exo -34.55 -33.62 0.08 OUTLIER 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.309 2.673 . . . . 0.0 113.497 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.436 HD12 ' CE2' ' A' ' 9' ' ' PHE . 6.8 mt -64.77 -53.59 44.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 110.141 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.493 HG21 ' HB2' ' A' ' 70' ' ' HIS . 0.6 OUTLIER -38.74 128.89 1.15 Allowed Pre-proline 0 CA--C 1.537 0.463 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.647 179.595 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.08 165.7 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.687 2.258 . . . . 0.0 112.251 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.9 mt -52.21 -51.28 59.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.264 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -57.89 -60.11 4.22 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.218 0.532 . . . . 0.0 110.387 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.493 ' HB2' HG21 ' A' ' 66' ' ' ILE . 18.5 m170 -60.12 -19.87 55.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.618 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.21 -53.55 29.19 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.425 HG11 ' N ' ' A' ' 73' ' ' GLU . 7.4 p -61.65 -35.26 66.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.248 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.425 ' N ' HG11 ' A' ' 72' ' ' VAL . 12.0 tp10 -70.92 -42.99 69.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.088 179.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.232 179.346 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.0 mt . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.881 0.372 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.487 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.3 OUTLIER -51.76 -53.03 44.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -60.48 -31.81 70.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.777 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.56 -40.04 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.76 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.41 HG22 ' CD1' ' A' ' 65' ' ' LEU . 9.4 t -71.06 -40.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.856 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 1.1 mt -63.33 -45.7 90.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.035 0.445 . . . . 0.0 109.981 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -60.39 -38.69 84.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.466 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.572 179.701 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.895 0.379 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -65.0 -35.41 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.2 t -61.75 -35.05 65.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.202 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.69 -50.97 46.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.209 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.433 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 2.8 ttp180 -63.9 -26.84 68.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.422 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.73 -49.32 48.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.66 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.6 -43.36 72.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -44.76 81.57 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.933 178.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.4 t-160 -58.24 -42.75 87.03 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 109.817 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -59.62 -32.96 70.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.199 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.413 ' O ' ' N ' ' A' ' 17' ' ' ILE . 44.9 t -64.57 -47.58 88.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.58 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -57.6 -41.07 80.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.382 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.97 -31.42 70.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.742 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -101.4 8.96 41.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.611 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.423 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.4 mm -149.06 69.04 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-O 121.701 0.763 . . . . 0.0 110.148 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.81 -36.13 76.11 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.789 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -63.79 150.17 45.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.672 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -86.89 -30.18 21.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.091 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.61 -52.63 63.57 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.004 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -50.88 -34.7 29.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 82.2 mttt -72.74 -34.27 66.92 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.89 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.1 -45.5 88.38 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.153 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -62.49 -42.81 99.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.158 179.308 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.18 -40.99 82.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.441 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 13.4 m-30 -61.01 -43.03 99.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.293 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -68.61 -36.69 79.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.608 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.6 t -64.56 -50.43 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.705 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HB3' ' CD2' ' B' ' 105' ' ' LEU . 18.0 mt -60.62 -40.66 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.514 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.71 -39.07 87.18 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.329 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.6 mmt -60.71 -52.08 66.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.349 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.513 ' O ' ' HA ' ' A' ' 37' ' ' MET . 8.7 t80 -53.53 -40.82 65.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.323 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -74.39 -38.2 63.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.86 0.362 . . . . 0.0 111.354 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -54.87 5.89 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -86.22 -25.56 25.54 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.513 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.4 mmt 61.56 35.11 17.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 110.655 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -114.97 124.56 51.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.849 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.8 t -76.74 -12.64 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.192 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.15 -36.05 55.58 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 120.948 0.404 . . . . 0.0 110.287 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.8 t -70.13 -34.93 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.129 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.482 ' CD1' ' CG ' ' A' ' 33' ' ' TYR . 7.3 mt -66.61 -49.18 67.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.585 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.2 t -58.15 -37.48 62.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.073 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.26 -59.58 8.74 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.826 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.07 -42.93 79.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.889 0.376 . . . . 0.0 111.21 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' A' ' 50' ' ' ILE . 41.7 mt -50.45 -47.53 56.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -58.27 -45.23 88.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 mt -53.21 -40.88 64.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.8 p -101.08 4.22 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.449 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.568 HG12 ' HB2' ' A' ' 58' ' ' LEU . 60.0 mt -140.2 29.55 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.217 0.532 . . . . 0.0 111.219 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.481 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.4 p30 -89.2 15.73 8.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.628 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -129.59 150.12 74.8 Favored Pre-proline 0 C--N 1.333 -0.132 0 C-N-CA 121.126 -0.229 . . . . 0.0 110.491 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.68 -38.69 66.61 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.325 2.017 . . . . 0.0 111.429 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 t -69.42 -36.8 77.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.608 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.446 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 53.5 mtt85 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.647 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.673 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.1 mt -53.45 -49.78 86.55 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.673 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.7 Cg_endo -41.16 -27.91 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.022 2.482 . . . . 0.0 113.493 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.568 ' HB2' HG12 ' A' ' 50' ' ' ILE . 6.7 mt -70.74 -35.27 72.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.782 0.325 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.403 ' CD2' ' OH ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -58.04 -44.73 87.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.265 179.325 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.2 OUTLIER -75.31 -31.08 60.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.675 179.512 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.483 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -62.31 -59.85 4.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.408 HG13 ' CD1' ' A' ' 65' ' ' LEU . 0.1 OUTLIER -60.52 -38.04 76.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.34 -179.241 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.453 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -38.13 -66.29 0.31 Allowed Pre-proline 0 N--CA 1.469 0.476 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.772 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 82.3 Cg_exo -38.69 -32.12 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.835 2.357 . . . . 0.0 113.512 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.507 HD12 HG23 ' B' ' 104' ' ' VAL . 19.4 mt -65.44 -46.47 79.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.656 0.741 . . . . 0.0 109.851 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.452 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -54.52 133.47 63.4 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.18 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.74 165.56 0.73 Allowed 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.496 2.131 . . . . 0.0 112.168 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.2 tp -56.59 -57.09 13.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.979 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -57.86 -52.17 66.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.117 0.485 . . . . 0.0 110.388 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.452 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.26 -43.5 98.7 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.188 179.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.8 -45.87 97.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.118 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.14 93.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.072 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.403 ' OH ' ' CD2' ' A' ' 59' ' ' PHE . 53.5 t80 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.324 179.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt . . . . . 0 C--O 1.233 0.191 0 CA-C-O 120.831 0.348 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.4 OUTLIER -52.02 -39.47 59.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.843 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.421 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 28.2 ttpp -61.01 -42.46 98.5 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.598 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.23 -38.48 83.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.897 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.507 HG23 HD12 ' A' ' 65' ' ' LEU . 23.8 t -68.03 -37.08 77.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.362 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -61.92 -44.06 97.56 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 178.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.51 -36.82 84.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.606 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 179.801 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.1 ttt-85 . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 120.801 0.334 . . . . 0.0 110.959 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -35.43 81.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.39 -40.13 85.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.99 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.78 -50.95 54.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -66.15 -26.9 67.64 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.12 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -71.69 -48.93 44.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.408 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.536 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.5 -43.02 73.98 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.089 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -43.3 90.17 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.664 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 17.3 t-160 -57.27 -42.26 81.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.866 178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -59.32 -36.81 76.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.157 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.2 t -60.24 -46.68 94.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.315 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -57.6 -41.48 81.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.153 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.0 -31.77 70.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.603 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.5 mt -97.18 6.03 49.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.406 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.431 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.5 mm -145.32 67.78 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 121.721 0.772 . . . . 0.0 110.029 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.64 -33.81 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.927 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.48 165.8 13.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.654 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -101.65 -32.97 10.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.985 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.19 74.37 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.77 -34.57 27.8 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 36.5 mttt -72.91 -34.82 66.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.897 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -63.78 -42.69 97.71 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.227 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.83 -45.16 87.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.209 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.9 mt -60.66 -38.98 86.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.501 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.7 m-85 -61.34 -44.63 96.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.588 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.68 -33.96 77.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.597 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.402 ' CG1' ' HA ' ' A' ' 42' ' ' LEU . 42.3 t -65.52 -47.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.796 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.84 -42.71 99.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.661 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.18 -40.87 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.493 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -47.02 86.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.144 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.475 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 4.9 t80 -55.58 -46.45 77.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.875 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -74.9 -33.63 62.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.578 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -77.3 -55.05 5.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.9 p -89.51 -10.82 44.83 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.439 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.8 mmt 59.63 24.51 13.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.731 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -101.09 117.44 35.03 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.975 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.409 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 21.3 t -79.86 -21.93 11.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.009 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.61 -28.43 56.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.766 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.7 t -73.46 -44.19 54.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.759 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.475 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 2.4 pp -68.4 -38.39 81.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.74 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.432 HG23 ' CD2' ' A' ' 74' ' ' TYR . 91.5 t -63.95 -42.28 95.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.336 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.81 -58.36 14.63 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.165 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.54 -40.17 90.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.975 0.417 . . . . 0.0 110.709 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.422 ' O ' ' N ' ' A' ' 50' ' ' ILE . 12.3 mt -51.9 -43.19 63.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.608 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.473 ' O ' ' N ' ' A' ' 51' ' ' ASN . 1.6 tppt? -57.9 -47.48 82.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.14 0.495 . . . . 0.0 110.514 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.25 -36.39 63.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.71 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.9 p -101.22 2.25 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.553 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.56 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 53.4 mt -140.15 29.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-O 121.29 0.566 . . . . 0.0 110.869 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.473 ' N ' ' O ' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -87.24 17.59 4.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.966 -179.869 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -128.36 142.2 43.9 Favored Pre-proline 0 CA--C 1.523 -0.07 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.54 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -46.75 -38.26 22.38 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.148 1.899 . . . . 0.0 111.498 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -35.66 76.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.583 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.56 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 18.9 mtt85 -90.83 -7.22 52.91 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.808 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.49 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.3 mt -57.15 -46.02 99.88 Favored Pre-proline 0 CA--C 1.531 0.244 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.49 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 91.2 Cg_exo -43.77 -26.76 1.33 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.766 2.31 . . . . 0.0 113.729 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HB2' HG12 ' A' ' 50' ' ' ILE . 8.5 mt -73.44 -30.29 63.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.757 0.313 . . . . 0.0 111.015 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.465 ' CZ ' ' HD3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -60.99 -48.45 81.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.618 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.442 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.9 OUTLIER -75.19 -31.0 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.77 179.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.47 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -60.73 -58.2 9.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.776 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.92 -36.85 77.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.957 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.429 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 1.1 ttp85 -36.5 -62.82 0.49 Allowed Pre-proline 0 N--CA 1.469 0.489 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.465 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.6 Cg_exo -33.97 -36.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.406 2.737 . . . . 0.0 113.545 -179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.463 ' CD1' HG23 ' B' ' 104' ' ' VAL . 15.2 mt -65.09 -56.8 10.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.413 0.625 . . . . 0.0 109.951 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.414 HG22 ' HB2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -44.24 133.65 4.4 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.187 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -50.94 165.34 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.607 2.205 . . . . 0.0 112.437 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.98 -55.38 33.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.05 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -57.52 -53.97 52.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.178 0.513 . . . . 0.0 110.342 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.414 ' HB2' HG22 ' A' ' 66' ' ' ILE . 44.5 m170 -60.99 -22.22 64.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.482 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.11 -54.93 16.78 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.974 0.416 . . . . 0.0 110.454 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.444 HG12 ' N ' ' A' ' 73' ' ' GLU . 7.4 p -59.18 -35.11 55.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.183 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.444 ' N ' HG12 ' A' ' 72' ' ' VAL . 4.1 tp10 -68.47 -37.37 80.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.968 178.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.432 ' CD2' HG23 ' A' ' 43' ' ' VAL . 9.5 t80 . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.216 179.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 10.9 mt . . . . . 0 C--O 1.233 0.213 0 CA-C-O 120.844 0.354 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.463 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 53.2 tp -51.77 -52.76 46.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.459 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -57.15 -31.57 65.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.595 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.22 -40.26 95.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.463 HG23 ' CD1' ' A' ' 65' ' ' LEU . 2.0 t -70.94 -36.17 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.929 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.3 OUTLIER -72.0 -45.51 60.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.847 0.356 . . . . 0.0 110.484 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -70.06 -33.82 72.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.774 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.756 179.816 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.7 mtt85 . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 120.888 0.375 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -33.58 71.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.514 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.04 -39.3 71.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.1 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.408 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -67.09 -50.91 60.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -64.91 -26.9 68.51 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.188 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -70.61 -49.12 51.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.526 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.518 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.75 -43.57 72.0 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.083 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.93 -41.82 88.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.736 178.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 -58.7 -42.3 88.27 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.784 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -59.91 -36.0 76.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.01 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.0 t -60.5 -49.09 85.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.519 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -57.63 -38.74 75.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.308 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.95 -35.3 76.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.421 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.2 mt -95.25 5.44 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.46 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 40.5 mm -147.61 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 121.611 0.719 . . . . 0.0 110.224 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -56.42 -39.72 73.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.891 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.17 179.17 0.15 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.681 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -111.44 -32.26 6.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.2 -53.02 62.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -50.81 -35.04 30.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 7.2 mttt -73.25 -34.26 65.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.904 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.48 -41.27 98.57 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.08 -46.07 82.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.218 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.55 -36.6 78.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.607 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.8 m-85 -62.83 -44.86 95.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.615 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.2 -40.55 90.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.548 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.416 HG12 ' CD2' ' A' ' 42' ' ' LEU . 22.2 t -60.29 -47.88 90.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.921 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.8 mt -59.87 -44.71 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.45 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -32.99 69.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.348 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.445 ' O ' ' N ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -64.48 -55.36 21.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.283 179.563 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.431 ' CG ' HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -53.45 -34.45 57.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -74.85 -53.38 9.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.523 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.27 -55.18 5.64 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' MET . 17.8 p -86.67 -47.64 8.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.658 0.266 . . . . 0.0 111.583 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 75.45 32.41 0.72 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.863 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.24 120.19 39.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.749 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.3 t -78.22 -16.54 13.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.252 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -36.55 53.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.99 0.424 . . . . 0.0 110.327 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.3 t -72.81 -34.17 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.018 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' CG ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -67.9 -44.31 77.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.89 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 59.5 t -57.46 -40.0 72.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.816 0.341 . . . . 0.0 110.925 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.49 -57.68 10.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.757 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.61 -48.91 75.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.999 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 51.2 mt -50.48 -44.45 55.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.016 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.39 -46.64 89.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.094 0.473 . . . . 0.0 110.463 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mt -51.98 -37.63 53.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.699 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.8 p -101.11 1.74 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.454 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.595 HG12 ' HB2' ' A' ' 58' ' ' LEU . 58.3 mt -135.13 27.41 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.304 0.573 . . . . 0.0 111.136 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 23.2 m-20 -84.39 12.08 7.4 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.885 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -126.29 145.41 52.53 Favored Pre-proline 0 C--O 1.231 0.11 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.767 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -47.95 -38.81 31.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.318 2.012 . . . . 0.0 111.692 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 p -69.27 -35.94 76.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.545 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.435 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 63.3 mtt85 -88.02 -8.55 55.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.636 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.627 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 16.6 mt -55.43 -53.48 61.71 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.531 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.627 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.2 Cg_exo -39.04 -29.19 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.362 2.708 . . . . 0.0 113.641 -179.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.595 ' HB2' HG12 ' A' ' 50' ' ' ILE . 35.7 mt -60.94 -37.03 80.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.425 ' CD2' HG23 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -60.96 -44.1 97.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.585 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.447 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.9 m-20 -75.0 -31.18 61.34 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.647 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 9' ' ' PHE . . . -63.82 -62.31 1.73 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.752 -179.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -35.06 71.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.055 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.453 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 5.8 ttt-85 -38.05 -65.32 0.38 Allowed Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.453 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 76.7 Cg_exo -36.16 -33.7 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 123.084 2.523 . . . . 0.0 113.406 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.441 HD12 ' CZ ' ' A' ' 9' ' ' PHE . 16.5 mt -65.14 -51.68 59.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.349 0.595 . . . . 0.0 110.128 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.437 HG22 ' HB2' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -45.08 132.15 5.47 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.351 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.493 ' HG2' ' HB2' ' A' ' 70' ' ' HIS . 2.8 Cg_endo -48.25 165.68 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.61 2.206 . . . . 0.0 112.123 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.1 tp -55.39 -56.12 23.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.419 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.1 pttt -56.3 -52.62 63.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.493 ' HB2' ' HG2' ' A' ' 67' ' ' PRO . 25.0 m170 -62.88 -29.19 70.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.477 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.03 -43.88 87.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.016 0.436 . . . . 0.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 t -67.85 -47.76 78.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.269 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.81 -27.9 69.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.508 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.0 t80 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.694 179.888 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.3 mt . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.811 0.338 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.408 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 40.5 tp -51.92 -52.62 48.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.99 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.415 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.0 OUTLIER -54.99 -35.35 64.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.923 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.04 -38.57 91.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.429 HG12 ' CZ ' ' A' ' 9' ' ' PHE . 24.1 t -69.8 -34.24 59.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.102 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.415 ' HG ' ' HA ' ' B' ' 102' ' ' LYS . 1.1 mt -64.44 -45.61 86.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.957 0.408 . . . . 0.0 109.959 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -35.19 80.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.566 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.575 179.746 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.689 0.281 . . . . 0.0 111.643 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -34.75 72.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.811 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.42 -37.58 80.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.4 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -69.04 -49.84 53.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.717 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -26.71 68.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.335 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -70.06 -49.31 52.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.449 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.522 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.86 -42.54 73.38 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.1 ttp85 -57.47 -44.1 84.6 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.664 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 18.3 t-160 -57.8 -43.33 85.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.209 0.528 . . . . 0.0 109.789 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -59.18 -35.23 73.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.193 179.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.411 ' O ' ' N ' ' A' ' 17' ' ' ILE . 61.5 t -62.05 -46.65 96.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.271 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -57.59 -39.3 76.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.005 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -69.07 -36.1 77.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.541 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.6 mt -96.49 8.39 44.21 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.572 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.419 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 34.5 mm -150.06 69.53 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-O 121.625 0.726 . . . . 0.0 109.986 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.85 -33.52 70.53 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.03 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -60.89 175.47 0.49 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -110.26 -30.44 7.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.71 -51.23 63.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.973 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -50.78 -34.69 28.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 73.4 mttt -72.14 -35.5 69.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.003 178.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.45 -40.66 97.35 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.049 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.304 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.71 -38.62 78.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.56 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 14.1 m-30 -64.73 -45.43 86.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.7 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.74 -38.04 89.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.886 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 36.3 t -63.0 -50.71 78.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.016 0.436 . . . . 0.0 110.952 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.417 ' CD2' ' CD1' ' A' ' 62' ' ' ILE . 13.0 mt -62.71 -40.41 97.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.483 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -65.36 -40.55 93.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.4 tpt -62.21 -44.85 95.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.371 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 6.3 t80 -57.45 -45.09 85.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.017 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -74.59 -33.67 62.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -55.0 5.8 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -82.33 -19.8 38.63 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 3.7 mmt 63.36 26.82 15.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.883 0.373 . . . . 0.0 110.652 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -114.06 121.39 43.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.412 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 22.0 t -78.38 -16.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.238 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.78 54.79 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.915 0.388 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.53 -43.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.793 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.468 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 3.4 pp -69.01 -38.28 79.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.629 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.433 HG22 ' CD2' ' A' ' 74' ' ' TYR . 79.5 t -61.56 -44.34 98.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.942 0.401 . . . . 0.0 110.377 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.31 -58.89 11.69 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.243 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -39.32 87.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.819 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 50' ' ' ILE . 12.0 mt -52.35 -45.02 65.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -57.36 -48.63 78.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.337 179.469 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.07 -39.46 56.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.873 179.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 p -100.94 4.93 10.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.42 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.538 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 62.3 mt -138.34 27.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.257 0.551 . . . . 0.0 110.868 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 47' ' ' LYS . 22.5 m-20 -84.69 12.59 6.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.835 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -125.37 148.31 60.71 Favored Pre-proline 0 C--N 1.334 -0.083 0 C-N-CA 121.13 -0.228 . . . . 0.0 110.552 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.79 -38.14 66.77 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.37 2.047 . . . . 0.0 111.466 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.6 p -69.54 -32.7 71.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.47 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.459 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 86.2 mtt180 -90.57 -11.46 39.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.572 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.486 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 14.5 mt -55.97 -45.91 99.83 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.675 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.486 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.9 Cg_exo -44.32 -24.88 1.1 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.786 2.324 . . . . 0.0 113.532 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.475 ' HB2' HG12 ' A' ' 50' ' ' ILE . 6.9 mt -73.12 -35.35 66.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.747 0.308 . . . . 0.0 110.984 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.06 -46.04 89.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 0.0 110.751 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.433 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.3 m-20 -75.04 -30.95 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.85 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.508 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -64.96 -63.39 1.12 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.984 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.417 ' CD1' ' CD2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -59.03 -37.42 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.457 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.7 mtm180 -38.45 -66.39 0.31 Allowed Pre-proline 0 N--CA 1.468 0.444 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.457 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 79.3 Cg_exo -37.05 -30.69 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.214 2.609 . . . . 0.0 113.54 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.437 HD13 ' CE2' ' A' ' 9' ' ' PHE . 16.2 mt -65.18 -49.82 68.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.524 0.678 . . . . 0.0 109.651 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.447 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -53.07 138.42 46.12 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.744 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -48.34 165.46 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.691 2.26 . . . . 0.0 112.427 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 tp -56.93 -57.11 13.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.967 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -57.13 -53.59 56.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.129 0.49 . . . . 0.0 110.251 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 24.1 m170 -59.21 -28.73 66.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.451 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.31 -42.23 93.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.3 t -62.89 -42.78 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.497 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -64.46 -45.68 86.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.341 179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.433 ' CD2' HG22 ' A' ' 43' ' ' VAL . 8.5 t80 . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.375 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.796 0.331 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 2.6 pt? -51.81 -43.84 63.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.848 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.441 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 8.6 tttp -59.34 -33.91 71.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.382 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -68.1 -36.45 79.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.56 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.4 ' CG2' ' CB ' ' A' ' 6' ' ' ALA . 22.9 t -68.37 -34.15 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.868 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.8 OUTLIER -68.4 -45.55 72.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.423 179.451 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.32 -39.87 92.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.648 179.873 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.797 0.332 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.4 -37.97 79.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.008 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t -58.07 -42.5 83.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.208 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.403 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -65.33 -50.95 63.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.995 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -26.79 69.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.315 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -70.12 -49.11 54.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.591 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.523 ' CD1' ' HB3' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.4 -42.67 71.35 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 179.012 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.423 ' HA ' HG23 ' A' ' 13' ' ' VAL . 6.8 tmm_? -58.44 -42.04 86.47 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.656 178.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.06 -46.15 88.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.453 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.402 ' HG2' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -60.38 -31.72 70.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.403 179.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.423 HG23 ' HA ' ' A' ' 10' ' ' ARG . 47.6 t -63.64 -48.05 88.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.36 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.62 -41.31 81.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -69.15 -35.23 76.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.315 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.2 mt -93.38 6.95 46.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.525 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.427 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 39.1 mm -142.31 66.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-O 121.782 0.801 . . . . 0.0 109.98 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -51.43 -31.57 23.5 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.044 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.73 170.66 11.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.719 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.01 -30.13 9.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.95 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.96 -50.26 72.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.014 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -50.72 -34.59 27.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.36 0.6 . . . . 0.0 109.397 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 33.6 mttt -71.75 -35.59 70.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.935 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.49 -42.55 99.57 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.19 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.72 -44.6 89.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.403 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.52 -36.51 76.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.711 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 12.8 m-30 -64.19 -48.52 75.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.617 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.32 -38.64 80.8 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.784 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 t -60.86 -52.54 60.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.08 0.467 . . . . 0.0 110.793 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 28.5 mt -59.58 -42.97 93.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.317 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.98 -36.71 70.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.465 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 1.8 mmt -63.56 -48.37 77.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.105 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.512 ' O ' ' HA ' ' A' ' 37' ' ' MET . 0.1 OUTLIER -53.39 -39.44 64.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.0 179.634 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -74.85 -46.13 38.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.84 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.465 ' HG2' ' HA ' ' A' ' 32' ' ' MET . 7.4 pt20 -77.54 -52.68 8.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -178.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.4 p -92.78 -31.76 14.92 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.512 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 4.7 mmt 63.77 31.19 14.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.979 0.419 . . . . 0.0 110.79 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -104.87 118.51 36.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.6 t -77.95 -14.61 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.463 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.07 -34.07 59.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 110.324 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.3 t -72.61 -37.76 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.203 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.416 HD12 ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -65.24 -44.41 88.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.937 179.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 56.5 t -54.56 -43.66 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-O 120.796 0.332 . . . . 0.0 111.2 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.38 -56.41 15.64 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.688 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.43 -52.19 66.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.866 0.365 . . . . 0.0 111.1 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' A' ' 50' ' ' ILE . 0.7 OUTLIER -50.42 -45.01 55.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.073 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.47 ' O ' ' N ' ' A' ' 51' ' ' ASN . 6.0 mttp -57.62 -48.39 79.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.118 0.485 . . . . 0.0 110.704 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.8 mt -54.1 -37.56 64.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.876 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.4 p -101.04 3.47 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.332 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.536 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 61.4 mt -139.18 27.86 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-O 121.305 0.574 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.47 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -88.6 16.86 6.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.72 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -128.94 142.87 46.59 Favored Pre-proline 0 C--N 1.335 -0.046 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.579 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -45.68 -39.16 17.88 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.254 1.97 . . . . 0.0 111.927 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -69.12 -34.84 75.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.719 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.491 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 46.8 mtt85 -91.78 -9.71 42.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.91 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.491 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.5 mt -55.28 -46.12 99.74 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.651 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.47 -25.69 2.34 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.78 2.32 . . . . 0.0 113.523 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.521 ' HB2' HG12 ' A' ' 50' ' ' ILE . 3.4 mt -73.81 -34.15 64.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.85 0.357 . . . . 0.0 111.03 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -59.93 -50.86 72.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.436 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 5.0 t0 -75.2 -31.16 60.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.523 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -60.85 -53.67 54.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.052 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -66.15 -36.78 78.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.906 0.384 . . . . 0.0 111.75 -179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.402 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -35.51 -61.24 0.54 Allowed Pre-proline 0 N--CA 1.469 0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.294 -179.234 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 75.8 Cg_exo -34.75 -33.98 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.511 2.807 . . . . 0.0 113.467 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' A' ' 9' ' ' PHE . 15.1 mt -65.2 -53.97 36.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.596 0.712 . . . . 0.0 109.525 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.421 HG22 ' HB2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -46.41 136.64 7.13 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.135 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -67.18 165.7 25.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.448 2.098 . . . . 0.0 112.028 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.9 tp -51.13 -50.37 59.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.174 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -58.43 8.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.919 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.421 ' HB2' HG22 ' A' ' 66' ' ' ILE . 18.2 m170 -62.05 -25.79 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.397 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.28 -42.33 99.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.017 0.437 . . . . 0.0 110.047 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 35.1 t -67.74 -44.74 85.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.424 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -67.22 -33.76 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.408 ' OH ' ' CD2' ' A' ' 59' ' ' PHE . 50.8 t80 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.328 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.753 0.311 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 3.3 tp -56.18 -52.62 63.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.986 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -63.07 -31.56 72.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.879 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.24 -44.66 91.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.323 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.403 ' CG2' ' CB ' ' A' ' 6' ' ' ALA . 24.7 t -66.08 -54.2 29.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.227 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 4.4 pp -61.75 -32.88 73.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -73.96 -40.35 63.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.717 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 179.901 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.721 0.296 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.78 -34.24 71.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.765 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -66.44 -35.1 74.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.75 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.402 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -70.01 -50.26 43.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.975 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -26.78 68.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.249 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.53 -49.11 51.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.389 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.538 ' CD1' ' HB2' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.55 -43.99 71.82 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.058 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -59.07 -40.82 86.38 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.581 178.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -59.33 -42.49 91.58 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.831 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.6 mttp -60.39 -37.23 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.272 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.401 ' O ' ' N ' ' A' ' 17' ' ' ILE . 41.9 t -59.9 -48.93 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -57.62 -39.07 76.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.219 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -69.05 -32.45 71.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.481 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.0 mt -100.42 8.53 43.54 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.529 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.441 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 35.3 mm -147.02 68.52 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.702 0.763 . . . . 0.0 110.051 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -58.78 -33.37 70.24 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.891 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -72.72 139.15 47.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.742 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -75.46 -28.87 59.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.033 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -52.65 64.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.032 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -50.98 -34.76 30.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 17.7 mttp -72.21 -34.25 68.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.887 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -61.61 -41.8 97.98 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.188 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.76 -42.08 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.291 179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.5 mt -63.1 -39.01 93.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.532 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.401 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.7 m-85 -62.67 -44.48 96.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.63 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -63.5 -44.51 94.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.547 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.6 t -59.46 -46.49 92.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 mt -59.7 -44.41 93.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.426 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.86 -36.24 72.07 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.508 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.428 ' O ' ' N ' ' A' ' 36' ' ' THR . 25.8 mtp -63.35 -48.94 75.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.139 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.441 ' CE2' HG13 ' A' ' 66' ' ' ILE . 0.1 OUTLIER -53.54 -42.55 67.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.878 0.37 . . . . 0.0 110.883 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -44.55 49.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.869 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -77.34 -55.01 5.76 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.428 ' N ' ' O ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -92.2 -43.39 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -178.666 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.435 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.5 ttt 74.51 32.98 0.88 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.853 0.359 . . . . 0.0 110.652 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -98.14 115.92 29.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.555 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.412 ' CG2' ' ND1' ' A' ' 70' ' ' HIS . 20.8 t -79.2 -16.63 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.447 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.88 -37.68 47.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.017 0.437 . . . . 0.0 110.478 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 25.4 t -73.56 -34.06 40.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.279 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.424 HD12 ' CB ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -69.51 -41.37 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.803 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.406 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 95.0 t -60.0 -40.06 82.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.639 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.17 -57.27 12.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.449 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.55 -48.66 76.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.871 0.367 . . . . 0.0 110.908 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 50' ' ' ILE . 65.6 mt -50.52 -41.93 54.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.874 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -62.15 -44.94 95.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.105 0.478 . . . . 0.0 110.435 179.621 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -54.95 -37.05 65.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.76 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.0 p -101.12 -0.78 10.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.394 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.543 HG12 ' HB2' ' A' ' 58' ' ' LEU . 49.0 mt -136.64 29.46 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.083 0.468 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -89.31 16.53 7.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.674 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -131.01 143.7 50.52 Favored Pre-proline 0 C--N 1.333 -0.112 0 CA-C-O 120.561 0.22 . . . . 0.0 110.435 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -46.25 -39.49 21.19 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.343 2.029 . . . . 0.0 111.974 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 m -69.21 -33.55 73.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.624 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.441 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 11.2 mtp180 -89.87 -12.04 40.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.477 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.482 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 14.8 mt -53.78 -46.07 98.56 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 94.1 Cg_exo -43.72 -27.21 1.44 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.706 2.271 . . . . 0.0 113.736 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.543 ' HB2' HG12 ' A' ' 50' ' ' ILE . 14.9 mt -73.72 -34.23 64.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 111.139 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -45.84 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 110.888 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.32 -31.48 60.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.832 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.538 ' HB2' ' CD1' ' A' ' 9' ' ' PHE . . . -62.35 -63.06 1.35 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.732 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.71 -30.86 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.971 0.415 . . . . 0.0 111.648 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.498 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 25.1 ttp180 -40.18 -60.26 1.54 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.498 ' CD ' ' HB3' ' A' ' 63' ' ' ARG . 6.7 Cg_endo -48.76 -25.64 8.5 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.69 2.26 . . . . 0.0 113.28 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.463 HD12 ' CE2' ' A' ' 9' ' ' PHE . 26.1 mt -65.57 -45.25 84.02 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.568 0.699 . . . . 0.0 109.575 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.487 HG21 ' HB2' ' A' ' 70' ' ' HIS . 1.3 mp -50.7 136.43 25.65 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.149 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.415 ' O ' ' N ' ' A' ' 71' ' ' GLN . 21.3 Cg_endo -61.39 165.78 12.47 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.576 2.184 . . . . 0.0 112.188 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 16.8 mt -52.01 -49.76 62.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.467 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -56.75 -61.35 2.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.162 0.506 . . . . 0.0 110.681 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.487 ' HB2' HG21 ' A' ' 66' ' ' ILE . 16.0 m170 -60.23 -26.66 66.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 67' ' ' PRO . 1.8 mm-40 -60.81 -46.95 88.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.041 0.448 . . . . 0.0 109.896 179.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 20.0 t -62.23 -45.0 99.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.935 179.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.12 -31.35 72.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.32 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.2 t80 . . . . . 0 C--N 1.332 -0.18 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.67 179.666 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 2.7 mt . . . . . 0 N--CA 1.463 0.182 0 CA-C-O 120.715 0.293 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.429 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 26.3 tp -53.35 -52.75 58.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.959 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -56.68 -31.66 64.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -67.63 -38.41 83.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.977 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.402 ' CG2' ' CB ' ' A' ' 6' ' ' ALA . 23.9 t -70.85 -34.93 57.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.482 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.5 OUTLIER -67.26 -45.62 76.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.425 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -73.61 -33.71 64.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.726 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.794 179.984 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.865 0.364 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -59.28 -33.52 71.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.9 t -61.61 -39.19 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.405 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -67.52 -50.96 56.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.183 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -66.68 -26.88 67.25 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.069 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -71.63 -48.93 44.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.372 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.538 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.32 -44.04 72.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.016 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.47 -41.13 89.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.838 178.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -58.46 -43.0 88.69 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.8 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -60.7 -35.47 76.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' ILE . 54.8 t -60.71 -48.46 88.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.465 179.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.62 -41.33 81.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.191 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -69.14 -32.61 72.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.472 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.7 mt -97.99 7.47 46.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.547 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.421 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 35.6 mm -146.59 68.63 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.931 0 CA-C-O 121.671 0.748 . . . . 0.0 109.861 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -55.92 -33.48 64.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.871 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -71.25 159.63 34.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.695 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.0 -29.78 15.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.975 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.54 -52.67 64.55 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -50.8 -34.77 28.93 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -72.88 -34.17 66.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.944 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -64.88 -44.67 88.92 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.249 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.8 -40.18 94.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.249 179.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -39.73 94.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.492 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -60.89 -43.57 98.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.481 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -64.81 -36.29 83.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.547 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.403 ' CG1' ' CD2' ' A' ' 42' ' ' LEU . 28.0 t -65.62 -45.41 92.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.407 ' HB3' ' CD2' ' B' ' 105' ' ' LEU . 12.9 mt -65.52 -43.3 90.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.522 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -63.63 -31.11 72.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.42 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -52.1 35.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.378 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.514 ' O ' ' HA ' ' A' ' 37' ' ' MET . 14.8 t80 -57.55 -33.88 68.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.996 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -74.57 -41.6 60.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.994 0.426 . . . . 0.0 111.018 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -77.45 -54.99 5.76 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.38 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 p -81.67 -28.79 33.37 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.514 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.0 mmt 64.13 35.46 10.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 110.607 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -118.21 124.23 47.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.7 t -77.63 -7.37 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.377 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -38.56 47.99 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.05 0.453 . . . . 0.0 110.269 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.25 -33.98 60.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.99 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.482 ' CD1' ' CG ' ' A' ' 33' ' ' TYR . 1.2 mt -66.82 -49.77 64.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.884 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 29.0 t -58.68 -42.87 86.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.477 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.35 -58.29 14.1 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.848 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -66.13 -40.9 91.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.258 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.442 ' O ' ' N ' ' A' ' 50' ' ' ILE . 20.7 mt -51.51 -47.44 63.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.096 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.48 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.76 -46.84 77.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 0.0 110.702 179.685 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.6 mt -53.57 -41.18 66.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.841 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.3 p -101.19 8.44 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.354 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 58' ' ' LEU . 71.2 mt -144.88 28.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.236 0.541 . . . . 0.0 111.094 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 47' ' ' LYS . 14.5 p30 -90.18 15.32 10.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.559 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -128.79 150.86 76.13 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.07 -39.21 70.75 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.38 2.053 . . . . 0.0 111.558 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.6 p -69.58 -34.01 73.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.806 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.451 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 45.6 mtt180 -90.22 -12.21 38.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.69 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.485 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -53.03 -46.33 97.7 Favored Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 83.4 Cg_exo -46.65 -24.92 3.17 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.806 2.337 . . . . 0.0 113.56 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.567 ' HB2' HG12 ' A' ' 50' ' ' ILE . 27.8 mt -67.23 -35.3 79.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.709 0.29 . . . . 0.0 111.189 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -45.01 95.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.519 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.408 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.3 t0 -75.2 -31.12 60.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.848 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.456 ' CB ' ' CD1' ' A' ' 9' ' ' PHE . . . -63.25 -54.69 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.093 -179.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -71.19 -38.1 69.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.544 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 2.0 tmm_? -36.94 -55.76 1.55 Allowed Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 81.5 Cg_exo -41.16 -34.23 1.55 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.766 2.31 . . . . 0.0 112.958 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.456 HD11 ' CE2' ' A' ' 9' ' ' PHE . 24.3 mt -65.31 -51.28 61.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.391 0.615 . . . . 0.0 110.338 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -44.78 134.75 4.84 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.186 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.17 165.55 1.33 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.636 2.224 . . . . 0.0 112.361 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.7 tp -55.8 -55.51 31.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.952 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.07 -53.61 56.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.034 0.445 . . . . 0.0 110.403 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.2 m170 -59.62 -31.02 69.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.324 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -45.64 92.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.3 179.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.6 t -61.53 -47.76 91.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.096 179.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.09 -29.19 69.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.199 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 16.7 t80 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.651 179.575 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mt . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.906 0.384 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.458 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 11.7 tp -54.43 -52.85 60.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.827 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.44 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -57.75 -31.63 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.036 179.745 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.55 -41.02 93.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.145 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.405 ' CG2' ' CB ' ' A' ' 6' ' ' ALA . 25.8 t -70.47 -36.12 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.505 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.7 OUTLIER -62.57 -45.65 91.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.91 0.386 . . . . 0.0 110.214 179.45 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -33.82 71.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.752 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.879 179.977 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.411 ' NH1' ' HB3' ' A' ' 3' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.465 0.321 0 CA-C-O 120.683 0.278 . . . . 0.0 111.541 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -59.05 -45.15 91.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.833 0.349 . . . . 0.0 111.029 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -58.98 -40.77 81.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.53 -49.03 58.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.878 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -66.11 -26.76 67.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.111 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -71.06 -49.12 48.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.375 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.532 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.25 -44.39 72.04 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.083 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.45 85.16 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.0 t-160 -57.63 -42.43 83.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.561 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -59.98 -36.78 77.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.911 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.56 -49.73 81.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.219 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -57.68 -38.25 74.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -68.93 -39.14 79.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.469 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.3 mt -93.02 7.44 44.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.434 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 42.4 mm -148.11 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.621 0.724 . . . . 0.0 110.141 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.85 -35.65 69.09 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.951 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.97 174.36 1.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -107.49 -33.29 7.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.935 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -51.48 69.24 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.986 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -50.8 -34.82 29.14 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 4.8 mttm -71.8 -34.61 69.52 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.97 178.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.45 -44.47 96.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.169 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.94 -41.71 95.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.357 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.58 -42.76 93.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 15.8 m-85 -61.46 -44.44 97.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.521 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.42 -32.92 72.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.846 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.404 ' CG1' ' CD2' ' A' ' 42' ' ' LEU . 21.5 t -66.07 -51.83 55.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.905 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.431 ' CD2' ' CD1' ' A' ' 62' ' ' ILE . 32.2 mt -62.05 -36.2 80.91 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.47 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -62.35 -38.81 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.385 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 10.3 mmm -65.19 -48.04 74.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.54 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CG ' ' CD1' ' A' ' 42' ' ' LEU . 11.0 t80 -57.35 -33.67 68.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -70.1 -52.61 22.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.219 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -77.46 -54.96 5.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.918 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 p -66.87 -38.72 86.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.893 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.417 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.1 mmt 64.67 28.87 13.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.84 0.352 . . . . 0.0 110.716 -179.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.16 127.13 53.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.8 t -75.26 -7.55 10.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.168 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.9 -36.47 56.64 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.008 0.432 . . . . 0.0 110.199 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.82 -33.97 54.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.468 ' CD1' ' CG ' ' A' ' 33' ' ' TYR . 2.3 mt -67.27 -47.77 69.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.833 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.3 t -57.72 -45.65 86.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.555 -179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.84 -57.39 17.71 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.049 -179.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.88 -42.93 94.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.705 0.288 . . . . 0.0 111.28 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 50' ' ' ILE . 26.9 mt -50.42 -53.29 30.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.5 mttt -53.18 -48.36 68.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.873 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.9 mt -49.96 -42.95 49.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.083 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.9 p -101.09 5.72 10.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.427 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.536 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 41.6 mt -138.19 28.39 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.329 0.585 . . . . 0.0 110.941 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 12.6 m-20 -84.84 13.68 5.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.907 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -126.31 143.03 44.55 Favored Pre-proline 0 N--CA 1.457 -0.085 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.633 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -46.86 -38.92 23.93 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.281 1.987 . . . . 0.0 111.801 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.4 t -69.3 -32.82 72.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.582 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.439 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 91.5 mtt180 -90.12 -12.69 37.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.547 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.495 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.5 mt -54.42 -45.98 99.2 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.495 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 98.7 Cg_exo -44.2 -30.9 3.78 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.788 2.325 . . . . 0.0 113.69 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.492 ' HB2' HG12 ' A' ' 50' ' ' ILE . 16.7 mt -64.6 -39.86 94.47 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.686 0.279 . . . . 0.0 111.272 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.407 ' CD1' ' OH ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -54.5 -47.26 73.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.006 0.432 . . . . 0.0 110.627 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -75.31 -31.26 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.715 179.475 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.467 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -61.81 -57.02 13.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.907 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.431 ' CD1' ' CD2' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.52 -37.41 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.043 -179.177 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.442 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.3 mtp85 -36.44 -64.58 0.36 Allowed Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 73.7 Cg_exo -36.49 -33.85 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.234 2.623 . . . . 0.0 113.221 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.463 HD13 ' CE2' ' A' ' 9' ' ' PHE . 24.4 mt -65.13 -51.28 62.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.447 0.641 . . . . 0.0 110.117 179.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.432 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.8 OUTLIER -45.37 135.32 5.62 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.304 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.16 165.67 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.667 2.244 . . . . 0.0 112.336 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.4 mt -56.03 -57.06 13.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.117 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -46.58 88.63 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.706 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 23.2 m170 -65.37 -25.48 67.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.476 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.46 -55.03 35.71 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.569 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.403 HG11 ' N ' ' A' ' 73' ' ' GLU . 7.5 p -62.83 -37.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.385 179.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.403 ' N ' HG11 ' A' ' 72' ' ' VAL . 0.5 OUTLIER -70.2 -31.69 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.362 179.318 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.407 ' OH ' ' CD1' ' A' ' 59' ' ' PHE . 11.4 t80 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.477 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.882 0.372 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.414 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 21.9 tp -53.99 -52.59 60.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.797 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -31.7 67.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.704 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.32 -38.81 91.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.883 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 22.1 t -69.66 -41.54 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.059 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 1.2 mt -57.61 -44.17 85.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.29 0.567 . . . . 0.0 109.909 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -73.66 -32.81 64.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.955 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.929 -179.0 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.861 0.362 . . . . 0.0 111.024 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.95 -42.79 99.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.813 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.21 -35.07 59.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.41 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -69.94 -51.05 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.004 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.28 -26.88 67.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.198 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.74 -45.97 60.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.456 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.552 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.7 -44.76 66.3 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.67 -42.77 89.25 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.15 -40.28 89.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.937 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -62.28 -36.27 81.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.06 179.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.403 ' O ' ' N ' ' A' ' 17' ' ' ILE . 47.2 t -59.41 -52.06 65.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.228 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -57.47 -35.22 69.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.167 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -69.01 -39.8 79.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.599 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 mt -98.12 11.17 38.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.557 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.406 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 36.0 mm -149.44 69.12 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-O 121.692 0.758 . . . . 0.0 110.143 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -60.42 -36.77 78.95 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.739 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -62.08 140.28 58.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.704 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.88 -36.61 56.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.36 65.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.852 0.358 . . . . 0.0 111.16 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -50.68 -34.75 27.85 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.417 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 9.9 mtpt -73.26 -35.34 66.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.847 178.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.09 -39.22 94.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.007 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.0 -43.41 78.94 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.311 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -62.87 -45.46 92.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.677 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.4 m-85 -60.93 -37.06 80.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.675 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.78 -32.99 73.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.592 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.0 -39.45 66.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.837 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.5 mt -69.89 -40.71 75.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.535 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -37.27 81.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.333 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.32 -46.03 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.13 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.442 ' CD1' HD22 ' A' ' 42' ' ' LEU . 6.4 t80 -60.15 -35.66 75.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.42 ' CE1' ' HE3' ' B' ' 102' ' ' LYS . 42.2 t-80 -74.58 -44.67 49.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.326 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -77.51 -54.98 5.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.162 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.3 p -74.17 -23.09 59.18 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 18.7 mmt 61.24 22.25 12.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.676 0.274 . . . . 0.0 110.798 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.47 116.45 30.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.707 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.415 ' HA ' ' CD2' ' A' ' 42' ' ' LEU . 21.6 t -80.15 -21.41 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.187 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.2 -32.46 56.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.7 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.2 t -73.4 -42.32 56.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.801 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.442 HD22 ' CD1' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -69.11 -36.15 77.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.701 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.411 ' N ' ' HG ' ' A' ' 42' ' ' LEU . 54.1 t -66.81 -43.16 89.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.023 0.44 . . . . 0.0 110.338 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.39 -56.05 27.23 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.334 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -60.99 -42.26 98.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.94 0.4 . . . . 0.0 110.719 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.419 HD13 ' CD1' ' A' ' 59' ' ' PHE . 12.2 mt -50.44 -43.74 55.18 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.743 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.3 mmtt -56.69 -50.59 71.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.245 0.545 . . . . 0.0 110.58 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -38.5 54.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.912 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.5 p -101.15 5.49 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.416 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.529 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 69.2 mt -141.31 29.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.272 0.558 . . . . 0.0 110.826 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 47' ' ' LYS . 16.5 m-20 -82.11 9.06 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.413 ' CG ' ' CD ' ' A' ' 55' ' ' ARG . 2.8 pt-20 -132.61 153.93 81.31 Favored Pre-proline 0 N--CA 1.462 0.157 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.367 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.23 -38.25 61.05 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.836 2.357 . . . . 0.0 112.168 -179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -32.47 72.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.411 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.489 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 14.8 mtp180 -94.47 -10.24 32.96 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.441 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.584 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.4 mt -54.13 -54.2 50.14 Favored Pre-proline 0 C--N 1.332 -0.161 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.6 Cg_endo -41.44 -24.89 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.123 2.549 . . . . 0.0 113.841 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.502 ' HB2' HG12 ' A' ' 50' ' ' ILE . 17.6 mt -73.74 -31.49 63.38 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.312 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.419 ' CD1' HD13 ' A' ' 46' ' ' LEU . 0.1 OUTLIER -72.36 -41.29 66.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 110.963 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.444 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 3.3 m-20 -75.03 -30.92 61.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.654 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.537 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -68.81 -60.08 2.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.009 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -59.06 -35.84 59.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.929 -179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.436 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.2 ttt-85 -41.82 -65.64 0.49 Allowed Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.126 -179.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.471 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.1 Cg_exo -35.57 -30.75 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.337 2.691 . . . . 0.0 113.757 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.439 HD12 ' CZ ' ' A' ' 9' ' ' PHE . 25.0 mt -64.94 -50.78 65.07 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.468 0.652 . . . . 0.0 109.784 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.498 HG22 ' HB2' ' A' ' 70' ' ' HIS . 1.6 mp -41.59 127.94 2.37 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.452 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.417 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 52.9 Cg_exo -55.21 165.8 2.75 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.66 2.24 . . . . 0.0 112.175 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 mp -52.19 -50.18 62.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.287 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -57.74 -60.6 3.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.168 0.509 . . . . 0.0 110.39 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.498 ' HB2' HG22 ' A' ' 66' ' ' ILE . 44.7 m170 -58.76 -24.23 61.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.378 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -44.43 83.36 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.087 0.47 . . . . 0.0 109.82 179.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.6 t -61.58 -42.96 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.736 178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 -31.74 70.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.147 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.3 t80 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.546 179.677 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mt . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.882 0.372 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.493 ' HG ' ' N ' ' B' ' 102' ' ' LYS . 2.1 pt? -52.24 -41.84 63.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.813 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.493 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 20.9 tttt -60.32 -38.84 84.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -34.41 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.722 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.413 HG21 HD13 ' A' ' 65' ' ' LEU . 2.8 t -70.97 -34.79 56.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.7 OUTLIER -66.67 -45.62 78.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.961 0.41 . . . . 0.0 110.065 179.195 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -69.87 -34.33 73.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.642 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.625 179.694 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 53.0 mtm-85 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.83 0.348 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -59.3 -36.54 75.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.96 -39.78 78.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.212 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HA ' ' CD2' ' A' ' 9' ' ' PHE . . . -67.27 -51.18 56.09 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.085 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.3 ttp-105 -65.77 -26.79 67.88 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.303 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -72.6 -48.74 37.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.47 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.534 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -68.86 -42.51 76.96 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.142 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.413 ' HD3' ' CG1' ' B' ' 104' ' ' VAL . 0.0 OUTLIER -61.26 -42.77 99.19 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.893 178.749 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -56.85 -41.44 77.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.176 0.512 . . . . 0.0 109.674 178.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -60.48 -38.05 83.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.018 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.402 ' O ' ' N ' ' A' ' 17' ' ' ILE . 57.5 t -57.68 -50.06 78.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.469 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -57.72 -37.81 74.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.105 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.593 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.6 mt -97.43 8.83 43.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.528 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.407 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.3 mm -148.96 69.13 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-O 121.619 0.723 . . . . 0.0 110.092 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -33.46 69.6 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.921 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.71 175.58 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.965 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -110.25 -29.76 8.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.959 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.53 -52.82 61.95 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -50.84 -34.88 29.69 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 11.2 mttt -72.95 -34.14 66.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.86 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -62.38 -42.65 99.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.041 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.93 -40.93 87.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.281 179.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 mt -61.46 -38.22 86.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.642 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.436 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 19.9 m-85 -65.48 -43.97 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.3 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.756 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 t -65.1 -50.18 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.905 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.9 mt -63.83 -33.5 75.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.426 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -67.02 -41.6 86.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.66 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.416 ' O ' ' N ' ' A' ' 36' ' ' THR . 0.2 OUTLIER -64.83 -43.55 92.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.411 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.489 ' O ' ' HA ' ' A' ' 37' ' ' MET . 1.7 t80 -60.79 -38.41 85.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.841 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -74.88 -46.79 33.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.869 0.366 . . . . 0.0 111.323 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -54.74 6.0 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -95.2 -34.71 12.13 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.331 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.489 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.1 mtt 72.74 32.03 1.53 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.808 0.337 . . . . 0.0 110.793 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.37 115.1 22.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.412 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 25.9 t -77.76 -23.71 14.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.8 -37.15 30.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.8 t -73.55 -35.86 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.664 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -73.96 -38.92 64.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.014 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.427 HG23 ' CD1' ' A' ' 74' ' ' TYR . 75.7 t -69.82 -43.04 80.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.936 0.398 . . . . 0.0 110.521 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.77 -50.01 72.29 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.404 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -62.95 -47.34 83.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.376 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' A' ' 50' ' ' ILE . 20.4 mt -50.8 -42.33 58.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 4.2 mtpt -58.48 -51.73 68.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.48 . . . . 0.0 110.811 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.7 mt -53.04 -35.54 59.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.941 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.7 p -100.97 3.21 10.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.36 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.603 HG12 ' HB2' ' A' ' 58' ' ' LEU . 54.7 mt -139.09 27.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.131 0.491 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -85.54 16.09 4.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.812 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -127.58 140.97 39.51 Favored Pre-proline 0 CA--C 1.523 -0.059 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.59 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -45.33 -38.88 15.78 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.378 2.052 . . . . 0.0 111.881 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 t -69.32 -34.76 75.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.716 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.586 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -89.72 -13.88 35.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.775 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.633 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 12.8 mt -49.0 -51.62 54.09 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.633 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 5.1 Cg_exo -39.97 -28.33 0.25 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.242 2.628 . . . . 0.0 113.893 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.603 ' HB2' HG12 ' A' ' 50' ' ' ILE . 9.3 mt -63.48 -38.58 91.7 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.644 0.259 . . . . 0.0 111.102 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.481 ' CE1' ' CZ ' ' A' ' 74' ' ' TYR . 0.2 OUTLIER -59.82 -44.0 94.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 0.0 110.674 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -75.1 -31.58 61.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.692 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.452 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -62.82 -60.25 3.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.391 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.406 ' CG1' HD11 ' A' ' 65' ' ' LEU . 0.2 OUTLIER -66.93 -30.01 48.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.829 -179.645 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.468 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 16.1 ttp180 -40.21 -58.08 2.52 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.2 Cg_endo -48.48 -30.0 14.92 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.706 2.271 . . . . 0.0 113.125 -178.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.446 HD12 ' CZ ' ' A' ' 9' ' ' PHE . 12.9 mt -65.37 -49.61 68.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.482 0.658 . . . . 0.0 109.872 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.454 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.7 OUTLIER -47.12 133.73 9.08 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.159 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.33 165.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.488 2.125 . . . . 0.0 112.14 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.6 tp -56.46 -57.79 10.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.871 0.367 . . . . 0.0 110.928 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.7 pttt -58.97 -48.93 79.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.081 0.467 . . . . 0.0 110.429 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -60.73 -29.21 69.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.386 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.66 -42.3 91.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.059 0.457 . . . . 0.0 110.241 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 31.1 t -62.45 -45.35 98.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.362 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.33 -31.88 69.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.458 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.481 ' CZ ' ' CE1' ' A' ' 59' ' ' PHE . 63.2 t80 . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.731 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 30.9 mt . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.673 0.273 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 101' ' ' LEU . . . . . 0.527 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.6 OUTLIER -51.76 -53.2 42.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.855 -179.842 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 pttt -61.2 -31.7 71.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.72 -40.39 94.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.945 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 104' ' ' VAL . . . . . 0.445 HG21 ' CD1' ' A' ' 65' ' ' LEU . 2.4 t -71.16 -46.5 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.458 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -65.08 -45.5 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.957 0.408 . . . . 0.0 110.478 179.845 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -66.03 -37.83 86.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.075 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 . . . . . 0 C--N 1.327 -0.411 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.34 -179.775 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 ptp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.868 0.366 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -130.71 34.4 4.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.88 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tpp85 -82.48 -34.17 28.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.973 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.03 -33.73 73.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.854 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.7 t -64.24 -35.58 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.71 -51.0 38.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.995 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.31 -26.84 68.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.229 179.313 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -70.76 -47.69 58.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.475 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.545 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.58 -44.53 67.18 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.455 ' CG ' ' CE2' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -55.93 -43.87 77.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.736 178.417 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.412 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 9.6 m170 -60.13 -41.14 92.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.085 0.469 . . . . 0.0 109.952 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -61.22 -37.55 83.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.129 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.402 ' O ' ' N ' ' A' ' 17' ' ' ILE . 47.0 t -59.97 -49.13 85.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.392 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.66 -37.54 73.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.178 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -68.84 -37.12 78.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.699 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 mt -97.72 8.96 43.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.535 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.402 ' N ' ' O ' ' A' ' 13' ' ' VAL . 36.7 mm -149.76 69.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-O 121.731 0.777 . . . . 0.0 110.112 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.803 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.83 160.72 16.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.724 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.73 -29.42 14.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.969 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.98 -53.64 54.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -50.91 -34.84 30.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.412 ' O ' ' CG ' ' A' ' 27' ' ' TYR . 8.2 mttm -73.52 -34.78 65.4 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.905 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -65.42 -43.8 89.36 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.15 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -64.37 -41.3 96.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.205 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.37 -39.85 95.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.359 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.412 ' CG ' ' O ' ' A' ' 23' ' ' LYS . 20.6 m-85 -60.29 -43.8 95.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.495 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -64.66 -34.43 78.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.498 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.403 ' CG1' ' CD2' ' A' ' 42' ' ' LEU . 17.5 t -67.82 -43.41 86.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.783 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.1 mt -66.12 -42.51 89.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.628 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -32.93 74.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.624 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.405 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 70.9 mmm -66.66 -47.06 73.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.453 ' CG ' ' CD1' ' A' ' 42' ' ' LEU . 13.3 t80 -59.37 -40.83 87.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.038 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -67.86 -43.39 79.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.346 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.405 ' HG2' ' HA ' ' A' ' 32' ' ' MET . 19.4 pt20 -77.24 -50.0 13.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.901 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.3 p -78.08 -30.5 49.64 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.42 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.2 mmt 62.64 28.73 16.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.952 0.406 . . . . 0.0 110.718 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -119.53 122.31 41.35 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.45 ' CG1' ' CD1' ' A' ' 74' ' ' TYR . 14.9 t -78.66 -7.27 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.537 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.0 -36.99 58.96 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.091 0.472 . . . . 0.0 110.22 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.95 -34.03 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.959 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.453 ' CD1' ' CG ' ' A' ' 33' ' ' TYR . 1.3 mt -65.52 -46.34 80.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.844 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.4 t -57.54 -45.73 86.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.423 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.91 -58.0 15.91 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.772 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -64.67 -36.35 83.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.089 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.4 ' CD2' ' CD1' ' A' ' 50' ' ' ILE . 13.8 mt -52.89 -55.02 26.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.831 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -54.48 -43.35 71.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.767 179.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.98 -45.78 61.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.788 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 13.4 p -100.98 8.42 8.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.342 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.536 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 60.1 mt -138.51 27.11 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.33 0.586 . . . . 0.0 111.034 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.46 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -85.78 15.91 4.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.803 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -127.65 144.27 50.53 Favored Pre-proline 0 C--O 1.23 0.072 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.427 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -48.7 -37.97 36.06 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.347 2.032 . . . . 0.0 111.513 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -69.38 -34.07 74.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.644 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.509 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -90.46 -12.45 37.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.79 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.48 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.8 mt -52.51 -45.86 95.5 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.9 Cg_exo -47.01 -23.92 2.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.735 2.29 . . . . 0.0 113.595 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.517 ' HB2' HG12 ' A' ' 50' ' ' ILE . 12.4 mt -73.73 -37.63 65.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.736 0.303 . . . . 0.0 111.322 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.419 ' CE2' ' HD2' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -60.06 -48.83 80.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.908 0.385 . . . . 0.0 111.111 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.402 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -75.22 -30.99 60.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.994 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.545 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.73 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.283 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -34.24 55.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.499 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -41.53 -63.12 0.89 Allowed Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.905 -178.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.499 ' CD ' ' HB3' ' A' ' 63' ' ' ARG . 87.0 Cg_exo -33.8 -33.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.338 2.692 . . . . 0.0 113.541 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.432 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.5 mt -64.91 -53.81 40.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.355 0.598 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.436 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.8 OUTLIER -43.41 132.19 3.59 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.116 179.52 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.4 ' HG2' ' HB2' ' A' ' 70' ' ' HIS . 18.2 Cg_endo -59.86 165.5 10.02 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.618 2.212 . . . . 0.0 112.019 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 tt -51.99 -51.36 57.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.219 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -61.06 2.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 0.0 110.539 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.434 ' HB2' HG21 ' A' ' 66' ' ' ILE . 36.8 m170 -59.21 -23.66 62.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -43.43 86.94 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.116 0.484 . . . . 0.0 110.166 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.2 t -64.85 -45.51 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.374 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -32.98 70.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.473 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.45 ' CD1' ' CG1' ' A' ' 39' ' ' VAL . 7.5 t80 -69.87 -46.8 64.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.539 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -61.93 -37.47 84.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.628 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -63.83 -45.24 90.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.704 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.3 mt -65.07 -34.84 79.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 14.0 p -77.18 154.17 82.36 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.002 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.51 74.24 1.19 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.717 2.278 . . . . 0.0 112.305 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.8 ttm-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.885 179.989 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.278 0 N-CA-C 112.774 -0.13 . . . . 0.0 112.774 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 56.29 83.56 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.738 0.304 . . . . 0.0 111.12 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 10.6 mt -72.4 -40.84 66.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.027 0.442 . . . . 0.0 110.83 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 9.5 tp -55.32 -52.66 62.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.597 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.406 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.5 OUTLIER -56.75 -33.41 66.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.05 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 22.9 t -68.69 -36.53 74.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.257 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.8 OUTLIER -63.5 -45.62 89.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 110.294 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.7 -35.8 81.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.623 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -60.68 -41.4 95.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.455 ' CE2' ' CG ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -68.11 -53.52 24.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.714 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 16.8 mt -51.17 -37.15 44.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.888 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -76.89 -36.67 56.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.383 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.63 -12.36 61.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.268 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 30.7 mmtt -78.91 -76.84 0.19 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.936 0.398 . . . . 0.0 110.793 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.938 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.71 0.29 . . . . 0.0 111.255 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -150.21 164.19 36.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.901 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -41.04 42.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.909 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.45 -33.55 73.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.825 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.0 t -61.42 -36.86 75.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.207 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.04 -51.16 41.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.105 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 3.2 ttt180 -67.17 -26.84 66.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.156 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -72.7 -45.99 55.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.289 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.571 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.76 -43.92 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -44.92 84.82 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.768 178.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.444 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 4.2 m-70 -58.91 -39.31 81.13 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.202 0.525 . . . . 0.0 109.743 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -62.47 -38.1 88.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.282 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' ILE . 52.9 t -59.6 -48.21 88.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.512 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -57.59 -42.64 83.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.17 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -69.01 -33.56 73.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.617 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 69.5 mt -95.4 6.44 49.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.651 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.408 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 40.3 mm -147.12 68.35 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-O 121.657 0.741 . . . . 0.0 110.037 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.15 -35.75 67.51 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.921 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -63.46 174.89 1.14 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -109.3 -30.51 7.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.41 -51.88 66.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -50.88 -34.8 29.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.39 0.614 . . . . 0.0 109.42 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -72.4 -33.67 67.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.26 -43.08 95.97 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.147 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -64.56 -43.22 94.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.233 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.4 tp -59.09 -41.13 87.33 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.54 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.41 ' OH ' ' CD1' ' B' ' 108' ' ' TYR . 14.9 m-85 -60.0 -47.92 83.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.76 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -59.09 -39.32 81.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.735 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.1 t -63.87 -49.65 80.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.737 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.4 mt -62.17 -40.71 96.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.365 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -60.27 -34.53 73.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.398 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.41 ' O ' ' N ' ' A' ' 36' ' ' THR . 4.2 mmt -66.08 -51.41 58.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.242 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.458 ' CD2' HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -53.53 -35.53 60.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.085 0.469 . . . . 0.0 110.543 179.419 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -55.64 5.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.84 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.69 -55.24 5.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.41 ' N ' ' O ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -82.74 -36.17 25.99 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.603 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.455 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.3 mmt 64.77 23.93 12.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.02 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.42 ' O ' HD12 ' A' ' 42' ' ' LEU . 29.4 t70 -100.59 114.74 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.333 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.5 t -73.01 -8.62 11.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.583 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.57 -34.26 60.67 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.072 0.463 . . . . 0.0 110.243 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.0 t -73.62 -33.85 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.417 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.458 HD11 ' CD2' ' A' ' 33' ' ' TYR . 0.5 OUTLIER -69.18 -42.63 75.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.831 179.901 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.7 t -58.06 -43.29 84.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.091 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.84 -56.17 15.95 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.78 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.08 -49.12 75.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.839 0.352 . . . . 0.0 111.203 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.415 ' O ' ' N ' ' A' ' 50' ' ' ILE . 68.5 mt -50.57 -48.0 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.086 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.77 -49.57 72.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.075 0.464 . . . . 0.0 110.634 179.776 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.85 -39.65 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.023 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.4 p -101.46 7.28 9.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.445 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.522 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 77.9 mt -143.15 28.06 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.257 0.551 . . . . 0.0 111.419 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.447 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.4 p30 -89.81 14.99 10.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.641 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -130.94 150.47 76.68 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.575 0.226 . . . . 0.0 110.607 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.1 -38.6 70.78 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.402 2.068 . . . . 0.0 111.447 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.32 -33.23 72.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.367 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.448 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 11.1 mtt85 -91.75 -5.88 52.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.573 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.494 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 14.6 mt -60.56 -44.8 96.58 Favored Pre-proline 0 CA--C 1.53 0.206 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.68 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 90.4 Cg_exo -43.48 -28.11 1.57 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.705 2.27 . . . . 0.0 113.421 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.522 ' HB2' HG12 ' A' ' 50' ' ' ILE . 16.0 mt -73.85 -33.91 64.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.902 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.442 ' CE2' HG23 ' A' ' 78' ' ' THR . 0.1 OUTLIER -61.28 -48.65 80.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.734 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.409 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.1 t0 -75.22 -31.0 60.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.651 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.71 -62.89 1.53 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.738 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.81 -31.78 53.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.724 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.469 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -37.15 -66.69 0.27 Allowed Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 112.327 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.475 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 76.8 Cg_exo -36.6 -32.39 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.092 2.528 . . . . 0.0 113.561 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.464 HD13 ' CE2' ' A' ' 9' ' ' PHE . 19.2 mt -65.67 -51.09 62.16 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.718 0.771 . . . . 0.0 109.439 179.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.433 HG21 ' CB ' ' A' ' 70' ' ' HIS . 1.9 mt -44.26 121.87 4.08 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.373 -1.285 . . . . 0.0 111.53 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.4 ' O ' ' N ' ' A' ' 71' ' ' GLN . 76.1 Cg_exo -47.84 165.75 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.832 2.355 . . . . 0.0 112.439 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.3 tt -55.51 -56.9 14.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.785 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -44.47 97.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.43 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.433 ' CB ' HG21 ' A' ' 66' ' ' ILE . 23.5 m170 -63.9 -29.3 70.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.288 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' A' ' 67' ' ' PRO . 1.4 mt-30 -61.51 -42.08 98.27 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.172 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.89 -46.26 89.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.09 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -65.01 -33.07 75.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.213 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -62.61 -46.62 87.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.512 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.418 ' O ' ' OG1' ' A' ' 78' ' ' THR . 6.9 t0 -66.32 -32.96 74.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.752 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -66.76 -35.37 79.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.107 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 28.4 mt -93.09 -24.09 18.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.039 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.572 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 2.2 p -46.51 -50.36 41.21 Favored Pre-proline 0 CA--C 1.533 0.3 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 78' ' ' THR . 22.2 Cg_endo -60.78 175.71 1.16 Allowed 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.112 1.875 . . . . 0.0 112.351 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.022 -179.929 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 29.9 t -157.87 99.43 1.69 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.846 0.355 . . . . 0.0 110.922 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.9 mt -77.31 -35.55 54.84 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.852 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 13.2 tp -54.45 -52.8 60.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.854 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 45.5 tttm -57.45 -31.52 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.835 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.98 -36.79 80.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.877 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 24.4 t -71.04 -37.19 66.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.8 OUTLIER -65.0 -45.57 85.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.006 0.431 . . . . 0.0 110.291 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -68.92 -34.63 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -60.88 -41.08 95.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.41 ' CD1' ' OH ' ' A' ' 27' ' ' TYR . 0.1 OUTLIER -70.73 -46.92 62.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.635 179.724 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 50.2 mt -51.18 -38.24 51.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.646 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 11.4 mtt-85 -76.91 -37.27 55.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.247 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -16.83 60.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.104 178.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -86.86 -48.49 8.15 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.815 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.861 179.996 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.744 0.307 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 t70 59.88 31.51 20.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.907 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.67 -32.05 7.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.991 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.07 -40.3 89.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.947 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.7 t -60.45 -35.02 60.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.003 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.406 ' CB ' HG23 ' B' ' 104' ' ' VAL . . . -69.27 -50.95 42.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.182 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.64 -26.77 67.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -71.22 -48.98 48.11 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.04 -43.02 72.13 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.919 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.462 ' NH2' ' CE1' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -56.87 -44.11 81.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.716 178.487 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 11.5 m170 -58.49 -42.68 88.13 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.2 -35.43 75.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.29 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 43.3 t -62.22 -49.03 85.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.616 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.63 -37.74 73.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.198 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -68.95 -30.11 68.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.456 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 mt -105.35 10.18 33.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.611 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.448 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.3 mm -146.26 67.96 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 CA-C-O 121.679 0.752 . . . . 0.0 110.151 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -79.12 -26.18 42.9 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.023 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.2 OUTLIER -49.2 -25.14 2.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.551 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 19' ' ' ASN . 5.8 t0 82.76 -53.14 0.19 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.097 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.57 -50.06 68.89 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -50.86 -34.59 28.67 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.446 ' HD3' ' CE1' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -69.23 -35.7 76.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.953 178.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' HA ' ' CD2' ' A' ' 27' ' ' TYR . 1.0 OUTLIER -62.23 -47.37 84.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.014 0.435 . . . . 0.0 110.187 179.467 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -61.41 -39.33 90.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.328 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.3 -40.99 92.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.497 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.421 ' CD2' ' HA ' ' A' ' 24' ' ' ASP . 11.6 m-85 -60.87 -46.82 89.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.408 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.43 -37.03 82.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.766 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.29 -44.64 99.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.0 mt -64.77 -46.41 82.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.509 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -32.33 72.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.23 -45.72 72.48 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.454 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.446 ' CE2' HG13 ' A' ' 66' ' ' ILE . 4.3 t80 -59.47 -38.37 80.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.963 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -74.52 -44.9 49.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.826 0.346 . . . . 0.0 111.544 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -55.09 5.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 112.059 -179.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 p -74.71 -40.24 61.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.426 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.2 mtp 69.96 26.04 4.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.89 0.376 . . . . 0.0 110.7 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.46 124.66 53.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.645 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.6 t -77.33 -10.36 13.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.207 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.72 -35.41 44.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.964 0.411 . . . . 0.0 110.61 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 32.8 t -71.11 -34.3 54.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.236 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' ' CD1' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -70.0 -47.99 59.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.002 179.78 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.9 t -57.44 -40.41 74.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.788 0.328 . . . . 0.0 111.039 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.93 -56.25 17.42 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.698 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.43 -48.61 77.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.838 0.351 . . . . 0.0 111.13 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' A' ' 50' ' ' ILE . 0.6 OUTLIER -50.56 -46.93 57.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.147 -179.707 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.3 -52.33 64.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.792 179.81 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.92 -38.6 36.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.958 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.7 p -101.2 4.6 10.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.594 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.515 HG12 ' HB2' ' A' ' 58' ' ' LEU . 58.2 mt -138.46 27.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 121.267 0.555 . . . . 0.0 111.161 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.435 ' N ' ' O ' ' A' ' 47' ' ' LYS . 34.3 m-20 -85.49 12.81 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.748 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.75 142.82 43.23 Favored Pre-proline 0 C--N 1.334 -0.071 0 O-C-N 122.3 -0.25 . . . . 0.0 110.674 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -46.27 -38.87 20.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.288 1.992 . . . . 0.0 111.788 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -33.62 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.588 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.429 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 40.8 mtt180 -90.75 -11.43 39.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.727 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.497 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -54.31 -45.35 99.28 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 88.0 Cg_exo -45.87 -24.76 2.28 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.853 2.369 . . . . 0.0 113.667 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.515 ' HB2' HG12 ' A' ' 50' ' ' ILE . 9.3 mt -72.92 -35.83 67.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.698 0.285 . . . . 0.0 110.919 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -50.79 72.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.751 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.422 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 2.8 t0 -75.38 -31.26 60.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.809 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.506 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -60.9 -56.25 23.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.849 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.17 -32.54 58.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 111.559 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.5 mtp180 -37.37 -63.72 0.47 Allowed Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.473 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.439 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 74.9 Cg_exo -36.9 -32.64 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.127 2.552 . . . . 0.0 113.617 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.487 HD12 ' CE2' ' A' ' 9' ' ' PHE . 14.1 mt -65.53 -50.75 64.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.624 0.726 . . . . 0.0 109.79 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -46.62 133.07 8.14 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.242 179.754 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -49.6 165.6 0.26 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.64 2.226 . . . . 0.0 112.284 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -57.87 10.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.855 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -50.02 75.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.039 0.447 . . . . 0.0 110.303 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.419 ' CB ' HG23 ' A' ' 66' ' ' ILE . 53.0 m170 -60.7 -27.59 68.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.374 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -65.35 -44.21 88.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.9 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 19.9 t -61.45 -43.54 96.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.326 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -66.51 -47.06 74.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.383 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -60.44 -37.44 80.92 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.443 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.479 ' O ' ' HD3' ' A' ' 79' ' ' PRO . 0.6 OUTLIER -65.76 -44.06 87.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.587 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -67.0 -24.61 66.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.551 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 mt -90.52 -26.0 19.98 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.542 ' N ' ' CD ' ' A' ' 79' ' ' PRO . 75.4 p -50.82 -37.65 35.18 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 78' ' ' THR . 1.9 Cg_endo -82.31 -175.16 2.38 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.687 2.258 . . . . 0.0 112.316 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 16.9 ptt-85 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.732 179.908 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 N-CA-C 112.551 -0.219 . . . . 0.0 112.551 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 74.3 p -147.7 113.01 5.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.824 0.345 . . . . 0.0 110.839 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 49.6 mt -114.2 -31.62 6.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.032 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.421 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -54.03 -35.18 61.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.128 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -33.19 73.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.95 -38.23 76.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.406 HG23 ' CB ' ' A' ' 6' ' ' ALA . 39.0 t -71.01 -51.0 38.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.371 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 pp -61.57 -33.48 73.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.573 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -73.79 -38.77 64.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 0.0 110.257 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -67.23 -29.18 68.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.591 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.462 ' CE1' ' NH2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.81 -56.57 4.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.013 0.435 . . . . 0.0 110.99 -179.953 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 4.0 pp -52.91 -39.46 62.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.67 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.03 -34.72 57.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.579 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . 0.418 ' CD1' ' NE ' ' A' ' 10' ' ' ARG . 5.9 mt -64.89 -17.11 64.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.177 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' B' ' 108' ' ' TYR . 28.9 mmmt -99.18 -40.56 7.91 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.679 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.888 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.433 0 CA-C-O 120.756 0.312 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.2 p-10 -141.61 -46.42 0.37 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.007 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.78 -34.83 18.17 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.948 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.95 -33.68 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.829 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.43 -35.92 74.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.22 -50.89 35.27 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.964 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -26.81 68.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.155 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -70.97 -48.98 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.357 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.535 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.04 -43.59 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.084 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.411 ' HG2' ' CD1' ' B' ' 108' ' ' TYR . 2.5 tpm_? -57.1 -44.94 83.7 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.712 178.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -57.83 -40.04 79.1 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.792 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.7 mtpt -62.82 -36.8 84.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.029 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 17' ' ' ILE . 46.5 t -58.59 -48.99 84.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.285 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -57.58 -42.25 82.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.081 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -69.1 -34.62 75.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.523 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.3 mt -95.12 7.34 46.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.595 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.412 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 40.0 mm -148.27 68.69 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.73 0.776 . . . . 0.0 110.129 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -57.16 -36.13 70.38 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.97 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -64.55 169.18 5.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.695 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -102.54 -31.46 10.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.95 67.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.933 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -50.77 -34.69 28.29 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.425 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 27.7 mttt -72.71 -35.19 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.939 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -62.86 -41.11 99.24 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.132 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.92 -45.75 80.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.298 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.36 -39.56 87.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.703 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.0 m-85 -61.82 -44.06 97.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.701 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -65.56 -40.98 93.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.648 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.82 -53.25 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.063 0.459 . . . . 0.0 110.982 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mt -59.98 -36.19 76.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.657 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -43.14 84.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.569 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -45.06 94.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.046 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.473 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 6.6 t80 -57.65 -48.17 80.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.781 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -74.99 -33.66 61.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.873 0.368 . . . . 0.0 111.664 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -77.44 -54.98 5.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.7 p -93.98 -6.0 46.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.467 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.5 mmt 58.87 23.5 11.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.708 0.29 . . . . 0.0 110.96 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -98.22 116.72 31.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.915 0.388 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.8 t -82.52 -20.7 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.27 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.64 -28.1 55.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.804 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.0 t -73.46 -43.77 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.779 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.473 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 2.5 pp -68.53 -39.21 81.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.753 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.425 HG22 ' CD2' ' A' ' 74' ' ' TYR . 84.9 t -60.65 -40.71 85.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.853 0.358 . . . . 0.0 110.389 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.51 -59.13 9.23 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.26 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -60.1 -44.2 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 110.771 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' A' ' 50' ' ' ILE . 12.7 mt -51.3 -44.13 61.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.73 -48.31 78.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.105 0.479 . . . . 0.0 110.627 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 mt -54.17 -37.53 64.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.824 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.9 p -101.04 5.13 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.428 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.546 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 65.7 mt -142.33 29.08 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-O 121.301 0.572 . . . . 0.0 110.72 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.7 p-10 -88.07 15.2 7.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.945 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.2 pt-20 -131.69 149.12 72.54 Favored Pre-proline 0 C--N 1.334 -0.098 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.765 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_endo -49.51 -38.51 44.47 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.697 2.265 . . . . 0.0 111.812 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.2 t -69.12 -33.93 74.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.609 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.513 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 97.9 mtt180 -94.5 -5.28 46.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.685 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.487 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 12.2 mt -59.44 -45.24 98.91 Favored Pre-proline 0 CA--C 1.532 0.284 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 81.4 Cg_exo -42.94 -29.03 1.38 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.772 2.315 . . . . 0.0 113.475 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HB2' HG12 ' A' ' 50' ' ' ILE . 14.4 mt -73.94 -32.29 63.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.741 0.305 . . . . 0.0 111.023 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.431 ' CE2' HG23 ' A' ' 78' ' ' THR . 0.1 OUTLIER -60.83 -50.02 75.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.095 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.407 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 22.5 t0 -75.21 -31.02 60.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.894 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.532 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.73 -60.26 4.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.95 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.3 -36.99 66.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.928 -179.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.475 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -36.32 -66.8 0.25 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.479 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.486 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 79.7 Cg_exo -36.14 -33.04 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.191 2.594 . . . . 0.0 113.342 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.448 HD13 ' CE2' ' A' ' 9' ' ' PHE . 22.7 mt -65.07 -51.93 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.0 109.875 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.416 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.7 OUTLIER -47.22 136.73 8.74 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.032 179.622 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.25 165.61 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.483 2.122 . . . . 0.0 112.34 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 tp -57.09 -57.87 10.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.955 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -51.41 69.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.106 0.479 . . . . 0.0 110.345 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.401 ' CB ' HG23 ' A' ' 66' ' ' ILE . 31.5 m170 -59.91 -28.31 67.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.325 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.32 -44.31 95.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.086 0.469 . . . . 0.0 110.155 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.32 -47.35 93.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.345 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.45 -39.38 93.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.356 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.426 ' CD1' HG21 ' A' ' 78' ' ' THR . 57.6 t80 -63.51 -42.69 98.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.691 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -45.5 91.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.704 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -59.97 -39.46 85.72 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.672 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.0 mt -70.58 -30.09 66.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.861 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.431 HG23 ' CE2' ' A' ' 59' ' ' PHE . 16.0 p -87.89 149.51 45.87 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.784 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -73.82 103.53 1.67 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.466 2.111 . . . . 0.0 112.346 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.922 179.983 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.554 -0.219 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 69.5 p -147.56 98.7 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.842 0.353 . . . . 0.0 110.856 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.0 mt -82.68 -55.03 4.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.952 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.444 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 13.9 tp -55.1 -52.86 61.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.093 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.6 -37.57 68.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.92 -36.54 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.719 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 2.1 t -71.09 -34.09 53.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.078 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -70.87 -45.72 63.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.973 0.416 . . . . 0.0 110.365 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.0 -39.74 87.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.903 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -59.65 -50.41 73.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.753 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.411 ' CD1' ' HG2' ' A' ' 10' ' ' ARG . 1.4 t80 -71.8 -43.88 64.9 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.811 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 13.2 mt -51.11 -40.78 59.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.662 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -76.89 -35.09 57.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.058 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -16.47 61.2 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.389 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 3.9 mmmt -81.44 -51.05 8.72 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.825 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.4 pttt . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.374 179.915 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.786 0.327 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -132.54 -179.95 5.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.89 -33.14 74.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.915 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -65.58 -36.81 84.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.753 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.2 -35.13 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.912 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.409 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -67.63 -51.15 53.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.271 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.427 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -64.41 -26.95 68.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.245 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.8 -49.08 50.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.538 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -68.83 -43.29 75.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.428 ' HG3' ' CG1' ' B' ' 104' ' ' VAL . 0.7 OUTLIER -61.96 -40.23 94.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.881 178.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.427 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 8.2 m170 -56.99 -41.37 78.28 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -60.96 -36.11 78.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.795 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ILE . 50.1 t -58.82 -48.7 85.38 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.105 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.17 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.7 -39.22 76.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.119 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -68.78 -31.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.465 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.3 mt -102.29 8.94 40.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.44 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.442 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 31.3 mm -149.97 69.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 CA-C-O 121.677 0.751 . . . . 0.0 110.025 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -58.96 -33.84 71.11 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.899 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -63.46 160.8 15.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.801 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -97.64 -30.76 12.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.978 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.15 -52.95 61.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.007 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -50.95 -34.78 30.22 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.2 mttt -72.82 -34.3 66.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.766 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -61.77 -43.03 99.65 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.55 -45.54 83.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.289 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.7 tt -60.81 -40.81 94.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.455 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.419 ' OH ' ' CE2' ' B' ' 108' ' ' TYR . 14.1 m-85 -59.26 -43.42 92.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -69.54 -37.34 77.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.813 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.7 t -62.36 -52.33 61.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.876 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.2 mt -60.9 -41.12 95.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.667 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -40.22 87.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.268 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -45.62 87.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.971 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.47 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 4.9 t80 -55.58 -44.67 77.1 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.941 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -74.87 -34.42 62.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.556 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.47 -55.06 5.7 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.0 p -88.07 -14.62 38.43 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.443 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.8 mmt 61.37 23.6 13.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.739 0.304 . . . . 0.0 110.626 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -98.48 116.72 31.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.744 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.433 HG23 ' CG ' ' A' ' 70' ' ' HIS . 21.4 t -81.27 -20.77 10.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.281 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.09 -29.27 48.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.339 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.2 t -73.42 -42.88 56.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.79 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.47 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 2.1 pp -70.2 -39.73 75.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.744 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 81.6 t -65.01 -37.36 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.938 0.399 . . . . 0.0 110.388 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.34 -56.68 18.59 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.137 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -64.72 -44.69 89.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.857 0.36 . . . . 0.0 110.774 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.413 ' O ' ' N ' ' A' ' 50' ' ' ILE . 13.7 mt -50.97 -41.07 59.15 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.688 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.48 -46.62 89.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.398 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.68 -34.49 65.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.563 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.4 p -100.92 0.3 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.3 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.548 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 50.8 mt -138.5 29.31 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.334 0.587 . . . . 0.0 110.939 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.483 ' N ' ' O ' ' A' ' 47' ' ' LYS . 20.7 p30 -87.53 16.77 5.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.787 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.7 mm-40 -127.35 143.57 47.7 Favored Pre-proline 0 C--N 1.334 -0.091 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.443 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -47.83 -38.47 30.37 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.452 2.101 . . . . 0.0 111.518 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.33 -33.8 73.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.713 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.523 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 1.8 mtt180 -92.04 -10.32 39.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.885 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.493 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.9 mt -55.62 -44.7 99.79 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.733 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.3 Cg_exo -44.31 -26.77 1.73 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.661 2.24 . . . . 0.0 113.474 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.477 ' HB2' HG12 ' A' ' 50' ' ' ILE . 3.7 mt -73.69 -32.0 63.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.842 0.353 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.54 -40.78 85.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.81 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 18.2 t70 -75.37 -31.0 60.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.811 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.486 ' HB2' ' CD1' ' A' ' 9' ' ' PHE . . . -68.63 -56.84 6.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.864 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.27 -38.16 79.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.86 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.444 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -39.69 -65.14 0.45 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.258 -179.002 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 70.6 Cg_exo -35.59 -32.91 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.261 2.641 . . . . 0.0 113.483 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.444 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.6 mt -65.07 -53.72 41.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 109.822 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.4 HG22 ' CB ' ' A' ' 70' ' ' HIS . 1.5 mp -42.26 128.15 2.8 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.306 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.79 165.69 1.09 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.791 2.328 . . . . 0.0 112.347 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -52.47 -53.6 43.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.031 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.51 -54.65 44.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.682 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.433 ' CG ' HG23 ' A' ' 39' ' ' VAL . 27.2 m170 -63.11 -20.44 65.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.555 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -53.91 32.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.967 0.413 . . . . 0.0 110.244 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.424 HG12 ' N ' ' A' ' 73' ' ' GLU . 6.1 p -61.91 -37.17 77.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.161 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.424 ' N ' HG12 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -70.68 -38.12 73.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.065 179.237 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -60.35 -49.08 78.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.468 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -62.91 -37.28 86.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.602 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -42.77 85.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.703 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.5 mt -72.75 -30.72 64.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.975 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 23.0 p -71.07 126.83 92.06 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.862 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.0 140.06 79.8 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.438 2.092 . . . . 0.0 112.103 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.884 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.534 -0.227 . . . . 0.0 112.534 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.74 -41.16 2.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.928 0.394 . . . . 0.0 111.037 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.9 mt -115.45 -33.17 5.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.413 HD21 ' CE2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -54.21 -40.55 67.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.993 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.84 -31.99 72.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.86 -34.9 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.053 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.428 ' CG1' ' HG3' ' A' ' 10' ' ' ARG . 25.2 t -70.85 -55.19 14.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.342 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 2.8 pp -58.6 -40.98 84.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.803 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -73.7 -33.42 64.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.804 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.57 -48.35 79.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.039 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.42 ' O ' ' HG2' ' B' ' 112' ' ' LYS . 0.3 OUTLIER -71.38 -48.97 46.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.864 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 10.0 mt -50.93 -38.66 51.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.499 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.88 -34.06 57.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.117 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 mp -66.37 -15.37 63.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.301 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . 0.42 ' HG2' ' O ' ' B' ' 108' ' ' TYR . 6.0 mmmm -72.09 -73.86 0.18 Allowed 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.775 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.921 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 ttm . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.81 0.338 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 3' ' ' ARG . 1.2 t0 -178.37 139.26 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.783 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 2' ' ' ASP . 10.3 mpt_? 69.93 -54.2 0.61 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.652 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.6 tttp -58.69 -33.4 70.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.9 0.381 . . . . 0.0 110.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 51.6 t -59.89 -38.66 77.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.425 ' CB ' HG23 ' B' ' 104' ' ' VAL . . . -67.71 -51.04 54.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.27 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -67.04 -26.88 66.97 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.108 179.392 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -72.64 -48.84 36.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.388 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.546 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -68.44 -42.86 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -58.26 -46.12 86.57 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.095 178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.7 t-160 -56.54 -42.05 77.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -60.75 -35.92 77.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.292 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.5 t -60.67 -49.84 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.601 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -57.75 -39.34 77.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.501 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -69.12 -30.12 68.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.735 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.4 mt -96.43 -0.22 49.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.621 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.427 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 91.4 mt -143.95 69.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 CA-C-O 122.122 0.963 . . . . 0.0 110.374 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -76.07 -2.81 32.63 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.88 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -71.66 -23.54 61.69 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 t0 78.55 -55.83 0.47 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.19 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -51.91 57.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.857 0.36 . . . . 0.0 111.245 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -50.88 -34.75 29.52 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -71.02 -34.46 71.32 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.89 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -45.09 96.06 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.114 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -64.57 -41.39 96.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.149 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -36.57 79.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.533 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.406 ' OH ' ' CE1' ' B' ' 108' ' ' TYR . 21.0 m-85 -64.6 -47.38 78.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.612 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.4 -37.22 86.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.594 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.8 t -69.34 -36.39 71.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.608 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.0 mt -68.53 -43.95 75.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.54 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -36.75 84.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.382 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -48.23 77.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.202 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.48 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 6.1 t80 -55.51 -43.06 75.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.992 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -74.78 -38.45 62.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.782 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -55.08 5.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.2 p -82.9 -13.81 55.38 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.427 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 20.5 mmt 60.45 21.18 10.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.768 0.318 . . . . 0.0 110.929 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.52 113.11 24.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.42 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 25.8 t -82.12 -23.32 9.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.225 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.82 -28.8 58.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.986 0.422 . . . . 0.0 110.915 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.8 t -73.42 -43.93 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.841 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.48 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -69.23 -37.04 77.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.678 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 71.7 t -62.09 -46.38 96.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.955 0.407 . . . . 0.0 110.144 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -58.42 -56.63 24.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.995 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -60.6 -36.94 79.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 110.447 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 50' ' ' ILE . 10.4 mt -52.45 -46.21 66.35 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.523 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.8 mptt -55.42 -46.38 76.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.543 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -54.41 -39.47 67.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.641 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.4 p -101.13 8.61 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.272 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.517 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 88.3 mt -144.79 28.68 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 121.305 0.574 . . . . 0.0 110.666 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' ' O ' ' A' ' 47' ' ' LYS . 21.9 p-10 -86.21 10.35 14.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.219 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -133.4 155.97 80.21 Favored Pre-proline 0 C--N 1.334 -0.084 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.249 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.29 -38.84 73.21 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.824 2.349 . . . . 0.0 112.086 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.75 -34.18 75.15 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.461 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.453 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 87.1 mtt180 -94.49 -1.21 53.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.743 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.49 ' HA ' HG21 ' A' ' 50' ' ' ILE . 11.9 mt -64.73 -47.41 75.45 Favored Pre-proline 0 CA--C 1.53 0.203 0 CA-C-O 120.605 0.24 . . . . 0.0 111.644 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.52 -26.81 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.732 2.288 . . . . 0.0 113.605 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.458 ' HB2' HG12 ' A' ' 50' ' ' ILE . 20.8 mt -69.71 -34.84 74.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.725 0.298 . . . . 0.0 111.242 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.4 ' CD2' ' OH ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -56.52 -48.38 77.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.01 0.433 . . . . 0.0 110.887 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.474 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.0 p-10 -75.28 -31.01 60.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.867 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.449 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.69 -56.96 14.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.996 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -37.64 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.458 -178.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.574 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 11.6 ttm-85 -37.37 -59.88 0.96 Allowed Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 90.8 Cg_exo -38.24 -37.14 0.6 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.86 2.373 . . . . 0.0 113.094 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.465 HD11 ' CZ ' ' A' ' 9' ' ' PHE . 12.3 mt -65.2 -54.11 34.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.369 0.604 . . . . 0.0 110.047 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -44.31 129.02 4.67 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.148 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.62 165.27 0.43 Allowed 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.63 2.22 . . . . 0.0 112.424 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.435 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.0 OUTLIER -56.16 -49.21 74.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.296 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -46.62 81.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.137 0.494 . . . . 0.0 110.418 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.415 ' ND1' ' CG2' ' A' ' 39' ' ' VAL . 29.2 m170 -64.95 -30.2 71.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.459 ' HG3' ' N ' ' A' ' 72' ' ' VAL . 0.0 OUTLIER -70.85 -32.28 69.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 0.0 110.298 179.547 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.459 ' N ' ' HG3' ' A' ' 71' ' ' GLN . 29.4 t -67.9 -46.2 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.061 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -69.18 -38.49 78.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.227 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.418 ' CD2' HG23 ' A' ' 43' ' ' VAL . 11.3 t80 -60.91 -42.68 98.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.335 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.411 ' HA ' HG22 ' A' ' 78' ' ' THR . 3.5 t0 -62.27 -48.72 78.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.522 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -66.63 -18.85 65.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.34 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.6 mt -86.58 -27.76 23.7 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.535 ' OG1' ' HD3' ' A' ' 79' ' ' PRO . 1.4 p -57.13 -46.03 99.88 Favored Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.535 ' HD3' ' OG1' ' A' ' 78' ' ' THR . 63.9 Cg_endo -72.89 -43.96 0.71 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.043 1.829 . . . . 0.0 112.2 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.928 -179.926 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 12.7 p 59.08 -172.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.299 . . . . 0.0 110.83 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 65.6 mt 69.69 -58.14 0.53 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.466 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.416 ' HA ' HD12 ' A' ' 65' ' ' LEU . 8.6 tp -51.63 -52.64 46.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.827 0.346 . . . . 0.0 110.984 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -31.5 65.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.674 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -69.86 -32.58 71.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.425 HG23 ' CB ' ' A' ' 6' ' ' ALA . 1.6 t -71.04 -43.27 76.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.668 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.67 -45.59 82.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.258 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.52 -33.64 73.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.63 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.79 -50.45 73.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.024 0.44 . . . . 0.0 110.899 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.406 ' CE1' ' OH ' ' A' ' 27' ' ' TYR . 1.9 t80 -74.43 -48.89 24.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.764 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 13.8 mt -51.33 -41.39 60.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.704 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 73.3 mtt180 -76.89 -33.87 57.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.283 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.35 -16.03 63.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.053 179.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 3.9 mmtp -75.16 -76.94 0.13 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.917 0.389 . . . . 0.0 110.824 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.2 mtmt . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.896 -179.969 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.818 0.342 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.48 152.64 18.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 80.38 -41.32 0.2 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.645 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -59.02 -33.38 70.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.754 0.311 . . . . 0.0 110.763 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -56.95 -38.61 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.012 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.411 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -67.33 -50.93 58.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.071 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -26.92 68.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.238 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -49.15 51.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.626 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.518 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.18 -43.19 74.72 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.802 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.424 ' CG ' ' CD2' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -56.88 -45.2 82.7 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.907 178.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -57.69 -41.82 82.42 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.117 0.484 . . . . 0.0 109.852 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -60.14 -35.98 76.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.001 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.0 t -61.21 -47.7 92.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.32 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -57.6 -39.03 75.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.149 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -69.0 -34.66 75.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.429 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 69.5 mt -95.88 6.28 49.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.508 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 39.2 mm -148.08 69.03 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-O 121.708 0.766 . . . . 0.0 110.081 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.56 -33.51 66.21 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.016 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.82 164.26 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.771 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -98.82 -32.7 11.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.942 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.93 63.16 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.953 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -50.87 -34.69 29.16 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 19.3 mttt -73.29 -34.77 65.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.947 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.73 -40.57 97.07 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.14 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.17 -43.65 81.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.2 tp -61.5 -38.11 86.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.647 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.438 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 20.5 m-85 -63.22 -46.3 87.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.664 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -38.07 88.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.626 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 t -62.24 -47.09 94.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.868 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.39 -44.79 90.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.496 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -65.4 -35.09 79.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.415 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.34 -44.71 74.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.442 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.459 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 8.9 t80 -61.08 -36.07 78.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.115 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -74.43 -41.0 61.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.581 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -77.43 -52.51 9.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.987 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.7 p -79.38 -21.93 45.04 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.8 mmt 60.66 22.39 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.672 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -104.13 119.77 39.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.776 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.432 HG22 ' CE1' ' A' ' 33' ' ' TYR . 21.9 t -79.14 -18.29 13.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.237 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.16 -29.63 48.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -73.47 -44.41 54.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.662 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.459 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 1.2 pp -68.98 -38.31 79.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.767 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 70.8 t -66.82 -37.32 79.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.917 0.389 . . . . 0.0 110.422 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.4 -57.96 14.47 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.68 -0.772 . . . . 0.0 111.894 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.69 -41.7 99.25 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.945 0.403 . . . . 0.0 110.634 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' A' ' 50' ' ' ILE . 11.2 mt -52.19 -40.17 61.15 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.622 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -59.92 -46.61 88.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.386 179.468 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 mt -55.53 -36.72 67.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.485 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.6 p -101.13 4.53 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.394 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.545 HG12 ' HB2' ' A' ' 58' ' ' LEU . 73.9 mt -142.52 29.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.26 0.552 . . . . 0.0 110.997 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.486 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.3 p30 -87.51 16.72 5.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.917 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.404 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 5.0 mm-40 -129.54 142.54 45.63 Favored Pre-proline 0 C--N 1.333 -0.11 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.65 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.69 -39.01 17.83 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.205 1.936 . . . . 0.0 111.835 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 t -69.25 -35.14 75.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.698 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.487 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 0.1 OUTLIER -89.96 -10.5 44.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.74 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.47 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 14.1 mt -53.08 -46.11 97.86 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 95.6 Cg_exo -44.17 -26.57 1.56 Allowed 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.727 2.285 . . . . 0.0 113.67 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.545 ' HB2' HG12 ' A' ' 50' ' ' ILE . 26.5 mt -73.67 -30.25 62.79 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.064 -0.254 . . . . 0.0 111.114 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -44.35 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.987 0.422 . . . . 0.0 110.704 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.31 -31.42 60.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.848 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.471 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.66 -57.32 10.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.656 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -31.46 53.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.514 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.46 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 2.7 ttp180 -40.04 -59.58 1.75 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.5 Cg_endo -48.81 -26.1 9.27 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.801 2.334 . . . . 0.0 113.348 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.465 HD12 ' CE2' ' A' ' 9' ' ' PHE . 21.0 mt -65.01 -54.54 28.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.35 0.595 . . . . 0.0 109.694 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.436 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.1 mp -42.07 136.03 2.26 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.425 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.428 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 54.2 Cg_exo -52.24 165.79 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.807 2.338 . . . . 0.0 112.46 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.3 -55.96 25.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.16 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -50.24 74.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.419 . . . . 0.0 110.435 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.415 ' CB ' HG22 ' A' ' 66' ' ' ILE . 26.8 m170 -61.73 -28.24 69.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.178 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.77 -43.72 98.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.92 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.3 t -62.31 -45.22 99.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.96 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.04 -30.75 71.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -62.01 -50.27 72.72 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.672 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.47 -42.23 98.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.678 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -59.24 -35.09 73.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.666 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.5 mt -81.55 -33.13 31.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.821 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.4 p -85.21 109.56 22.12 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.983 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.84 134.9 31.21 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.348 2.032 . . . . 0.0 112.375 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.801 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.19 83.83 2.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.933 0.397 . . . . 0.0 110.927 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.32 -39.26 89.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.927 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.436 ' CD1' ' CD2' ' A' ' 33' ' ' TYR . 0.3 OUTLIER -56.46 -36.75 69.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.928 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 3.8 tttt -68.54 -32.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.819 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.96 -37.31 75.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.082 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.417 HG21 HD13 ' A' ' 65' ' ' LEU . 33.2 t -69.58 -54.54 19.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.518 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 2.4 pp -57.34 -39.8 76.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.677 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.01 -34.86 66.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.342 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -65.19 -36.76 85.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.622 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.424 ' CD2' ' CG ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -69.54 -48.43 60.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.3 179.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 61.9 mt -53.04 -40.6 64.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.697 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 4.8 ptm85 -76.83 -39.17 52.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.007 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.18 -6.83 45.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.762 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -85.94 -78.6 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.854 0.359 . . . . 0.0 110.93 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.942 179.972 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 mtm . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 120.911 0.386 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.67 -30.15 19.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.95 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -31.07 70.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -59.61 -39.22 83.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.4 t -61.13 -35.06 63.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.882 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.423 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -69.02 -51.18 41.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.236 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.426 ' HA ' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -67.64 -26.87 66.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.25 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -73.18 -46.06 52.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.552 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.92 -44.74 65.56 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' HG3' ' N ' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -63.89 -35.99 82.48 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 179.259 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.47 ' N ' ' HG3' ' A' ' 10' ' ' ARG . 20.5 t-160 -62.32 -42.66 99.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -61.1 -35.91 78.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.82 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' ILE . 64.0 t -62.84 -44.85 99.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.306 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.48 -42.21 82.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.958 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -69.15 -37.17 78.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.267 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.3 mt -89.9 6.06 43.61 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.417 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.413 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.4 mm -145.91 67.98 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 CA-C-O 121.743 0.782 . . . . 0.0 110.208 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.41 -31.26 67.55 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.917 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -73.32 122.27 21.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -62.88 -27.55 69.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.106 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.34 -52.02 63.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.899 0.38 . . . . 0.0 111.079 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -50.8 -34.59 28.14 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -71.72 -34.7 69.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.815 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.63 97.55 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.13 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.4 -44.71 86.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.333 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.44 -41.75 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.539 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -59.62 -43.25 93.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.523 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.65 -35.99 82.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.459 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.401 ' CG1' ' CD2' ' A' ' 42' ' ' LEU . 24.4 t -65.6 -44.98 93.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.2 mt -63.85 -44.4 93.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.489 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.6 mtp180 -59.73 -34.06 72.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.21 -52.12 56.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.495 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.54 ' O ' ' HA ' ' A' ' 37' ' ' MET . 6.3 t80 -55.98 -34.36 65.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.123 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -74.84 -43.95 51.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.805 0.336 . . . . 0.0 111.109 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.74 -54.91 5.8 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 p -84.42 -33.08 23.79 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.54 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.2 mmt 63.77 39.28 8.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.987 0.422 . . . . 0.0 110.665 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -113.71 125.21 53.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.73 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 17.2 t -75.76 -14.0 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.988 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.71 -38.94 37.8 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.996 0.427 . . . . 0.0 110.215 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.8 t -69.41 -34.04 60.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.88 179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.432 HD11 ' CD1' ' A' ' 33' ' ' TYR . 1.7 mt -66.55 -50.71 62.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.549 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.1 t -61.61 -38.13 79.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.29 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.61 -56.65 23.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.821 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -72.95 -41.32 64.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.74 0.305 . . . . 0.0 111.341 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.444 ' HB3' ' CE1' ' A' ' 59' ' ' PHE . 30.5 mt -50.33 -45.19 54.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.949 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -61.78 -46.72 88.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.699 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.6 mt -50.83 -37.69 44.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.064 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 p -101.04 -6.55 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.491 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.636 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 7.4 mt -129.3 31.0 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.105 0.479 . . . . 0.0 111.303 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.474 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.3 p30 -86.68 16.2 4.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.743 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -127.33 141.21 40.14 Favored Pre-proline 0 C--N 1.334 -0.1 0 C-N-CA 120.986 -0.285 . . . . 0.0 110.659 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.15 -38.49 19.58 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.267 1.978 . . . . 0.0 111.678 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.5 p -69.36 -34.77 75.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.492 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.636 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -88.4 -13.91 39.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.589 -179.72 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.65 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 17.1 mt -50.34 -50.71 69.37 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.65 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 4.3 Cg_exo -40.06 -28.83 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.291 2.661 . . . . 0.0 113.754 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.623 ' HB2' HG12 ' A' ' 50' ' ' ILE . 7.5 mt -65.69 -32.04 73.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.767 0.318 . . . . 0.0 111.002 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.444 ' CE1' ' HB3' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -60.88 -40.65 93.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.319 179.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.408 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -75.13 -31.36 61.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.481 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.459 ' CB ' ' CD1' ' A' ' 9' ' ' PHE . . . -65.12 -57.91 7.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.198 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.418 HG13 ' CD1' ' A' ' 65' ' ' LEU . 0.1 OUTLIER -65.35 -35.58 75.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.749 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.456 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 7.8 ttp180 -38.55 -58.25 1.65 Allowed Pre-proline 0 N--CA 1.468 0.44 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 9.5 Cg_endo -51.92 -28.42 31.52 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.597 2.198 . . . . 0.0 112.869 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.476 HD11 HG22 ' B' ' 104' ' ' VAL . 20.4 mt -65.2 -44.5 88.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.673 0.749 . . . . 0.0 109.371 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.431 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -62.54 130.08 93.18 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.643 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -51.86 165.46 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.566 2.177 . . . . 0.0 112.218 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -55.55 30.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.075 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmtt -57.36 -54.2 49.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.034 0.445 . . . . 0.0 110.417 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -59.6 -28.32 67.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.454 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -61.72 -44.07 97.62 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 30.7 t -65.2 -45.06 94.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.275 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.11 -27.04 67.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.444 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -72.49 -46.12 56.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.517 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.21 -45.79 91.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.841 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -66.33 -40.87 90.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.064 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 22.9 mt -60.2 -35.53 75.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.202 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 13.6 p -52.54 107.25 0.79 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.159 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -81.04 -167.45 0.51 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.488 2.126 . . . . 0.0 112.389 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 121.001 0.429 . . . . 0.0 110.931 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 26.0 t -173.37 -78.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.863 0.363 . . . . 0.0 110.983 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 7.9 mt -81.96 -39.95 22.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.99 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.456 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.1 OUTLIER -53.5 -52.57 59.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 179.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.417 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -55.42 -32.74 62.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -39.27 85.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.476 HG22 HD11 ' A' ' 65' ' ' LEU . 21.7 t -71.03 -31.46 45.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.285 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.6 OUTLIER -68.53 -45.67 71.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.905 0.383 . . . . 0.0 110.3 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -69.4 -34.01 73.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.564 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -60.96 -45.53 94.37 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.638 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.5 -49.37 33.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.65 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 73.3 mt -52.86 -41.56 64.42 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.807 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 21.5 mtt-85 -76.8 -36.11 57.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.542 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 2.1 mt -73.05 -7.36 50.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.494 179.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 4.0 mttm -84.97 -76.45 0.31 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 121.039 0.447 . . . . 0.0 110.915 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.89 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.768 0.318 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -178.36 -39.47 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.86 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.06 -30.49 24.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.906 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -39.08 81.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.056 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.92 -40.66 63.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.213 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.07 -50.85 62.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 9.3 mtp180 -65.09 -26.72 68.34 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.01 -49.11 48.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.754 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.71 -41.61 71.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.071 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.17 92.53 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.818 178.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 12.3 m170 -59.29 -41.16 88.3 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 179.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -61.49 -34.52 75.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.171 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.412 ' O ' ' N ' ' A' ' 17' ' ' ILE . 47.8 t -62.13 -48.58 87.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -57.51 -40.18 78.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.175 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -69.06 -32.91 72.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.388 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -98.54 8.29 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.466 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.453 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 35.2 mm -147.68 68.56 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-O 121.721 0.772 . . . . 0.0 110.287 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -81.33 -8.82 59.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.274 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -66.93 -13.28 61.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.539 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.8 -61.61 0.49 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.609 0.242 . . . . 0.0 110.921 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.66 -48.73 66.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.916 0.388 . . . . 0.0 110.834 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -50.99 -34.45 29.13 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.78 -35.97 75.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.074 179.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.43 -44.61 86.8 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.998 0.428 . . . . 0.0 110.397 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -60.84 -44.17 97.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.587 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.29 -40.84 87.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.734 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -61.93 -41.43 97.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.768 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.36 -36.19 82.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.581 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.76 -36.63 70.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.835 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -70.24 -43.59 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.652 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.5 ttt85 -66.81 -35.45 80.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.485 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 23.7 tpp -69.14 -43.76 73.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.397 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.463 ' CD1' HD21 ' A' ' 42' ' ' LEU . 6.3 t80 -62.13 -39.64 93.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.905 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -74.86 -41.38 59.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.399 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -54.99 5.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.855 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 p -76.53 -23.14 53.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.84 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.431 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.5 mmt 63.64 18.38 11.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.771 0.319 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -97.87 116.6 30.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.757 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.5 t -79.41 -21.41 12.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.203 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.33 -30.81 54.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.877 0.37 . . . . 0.0 110.697 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.8 t -73.55 -41.88 55.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.677 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.463 HD21 ' CD1' ' A' ' 33' ' ' TYR . 0.7 OUTLIER -69.75 -38.09 76.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.696 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 76.4 t -65.87 -37.21 79.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 CA-C-O 120.961 0.41 . . . . 0.0 110.212 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.04 -57.98 13.65 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.962 179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -60.92 -44.37 97.28 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.021 0.438 . . . . 0.0 110.472 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 50' ' ' ILE . 10.7 mt -51.02 -40.73 58.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.3 OUTLIER -59.34 -50.24 74.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.271 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mp -51.45 -37.25 47.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.811 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.9 p -101.0 3.7 10.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.435 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.511 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 71.3 mt -140.4 29.64 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' A' ' 47' ' ' LYS . 27.0 m-20 -84.32 11.19 8.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.871 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -127.3 148.76 67.53 Favored Pre-proline 0 C--O 1.231 0.103 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.807 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.406 ' HA ' ' CD1' ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.69 -37.8 65.0 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.45 2.1 . . . . 0.0 111.445 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.29 -32.49 71.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.296 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.451 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 1.9 mtp180 -91.31 -9.22 45.81 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.391 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.5 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 18.1 mt -57.01 -44.55 99.83 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.718 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.17 -27.34 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.689 2.26 . . . . 0.0 113.577 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HB2' HG12 ' A' ' 50' ' ' ILE . 15.8 mt -70.51 -30.27 66.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.692 0.282 . . . . 0.0 111.037 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.378 . . . . 0.0 110.637 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -75.48 -31.27 60.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.805 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.435 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -65.57 -64.49 0.85 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.453 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.408 ' CG1' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -62.7 -28.32 44.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.423 ' HG2' ' CE2' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -41.72 -63.96 0.75 Allowed Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -178.857 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.415 ' HG2' ' O ' ' A' ' 61' ' ' ALA . 2.4 Cg_endo -46.25 -26.98 4.26 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.963 2.442 . . . . 0.0 113.214 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.475 HD11 ' CZ ' ' A' ' 9' ' ' PHE . 16.1 mt -65.41 -51.86 57.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 109.542 179.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.421 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.0 OUTLIER -47.68 129.89 11.05 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.7 -1.137 . . . . 0.0 111.156 179.458 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.408 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 53.7 Cg_exo -52.86 165.8 1.08 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.693 2.262 . . . . 0.0 112.418 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.9 mt -54.94 -56.85 15.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.135 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -54.6 44.58 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.249 0.547 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.421 ' CB ' HG23 ' A' ' 66' ' ' ILE . 20.1 m170 -57.54 -29.35 64.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.219 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.74 -44.26 96.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.846 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -59.29 -46.68 92.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.824 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.47 -31.13 71.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.99 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.423 ' CE2' ' HG2' ' A' ' 63' ' ' ARG . 2.3 t80 -59.99 -49.79 76.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.354 179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.452 ' HA ' HG21 ' A' ' 78' ' ' THR . 2.1 t0 -59.46 -48.26 82.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.76 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -66.3 -19.11 65.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.512 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.7 mt -89.03 -24.71 22.27 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.592 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 2.3 p -57.51 -44.94 99.86 Favored Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 78' ' ' THR . 44.0 Cg_endo -67.76 -26.82 38.45 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 121.882 1.721 . . . . 0.0 112.231 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.949 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' B' ' 100' ' ' LEU . 22.9 t -110.57 177.16 4.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.631 0.253 . . . . 0.0 110.855 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' B' ' 99' ' ' SER . 17.5 mt 68.06 -57.57 0.47 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.718 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.412 HD23 ' CE2' ' A' ' 33' ' ' TYR . 1.8 pp -51.59 -40.58 60.09 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.764 0.316 . . . . 0.0 110.871 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -33.84 74.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.329 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.04 -32.43 70.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.569 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 2.0 t -68.78 -39.92 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.48 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.5 OUTLIER -65.12 -45.64 84.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.334 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -33.83 73.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.616 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.46 -50.48 73.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.735 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.417 ' O ' ' HG2' ' B' ' 112' ' ' LYS . 0.3 OUTLIER -70.58 -46.14 64.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.691 179.796 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 11.0 mt -51.12 -37.62 47.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.521 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -76.94 -35.54 57.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.922 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.15 -15.76 62.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.194 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' B' ' 108' ' ' TYR . 5.1 mmmm -70.49 -73.85 0.16 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-O 120.957 0.408 . . . . 0.0 110.771 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.915 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.785 0.326 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.3 p30 -147.05 29.94 0.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.959 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -92.04 -36.75 13.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.836 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.52 71.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.3 t -57.78 -38.34 64.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.26 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.1 -50.94 51.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.15 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -26.7 67.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.174 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.19 -48.27 52.55 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.461 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.509 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.77 -43.2 69.27 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HG2' ' CZ ' ' B' ' 108' ' ' TYR . 1.2 ttp180 -58.05 -42.18 84.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.696 178.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.04 -44.65 94.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.436 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -61.58 -32.56 72.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.215 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.414 HG23 ' CD2' ' A' ' 58' ' ' LEU . 49.0 t -62.32 -49.37 84.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.123 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -57.65 -37.94 74.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.851 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.92 -41.81 77.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.336 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.4 mt -87.42 4.89 41.42 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.357 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.421 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 41.6 mm -143.0 67.07 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-O 121.785 0.802 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -54.41 -31.25 54.7 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.975 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -73.13 164.64 26.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.619 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.32 -28.68 13.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.991 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.54 -51.64 67.74 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.401 ' CB ' HG21 ' A' ' 17' ' ' ILE . 27.4 mt-10 -50.9 -34.77 29.79 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 17.9 mttt -71.53 -34.9 70.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.966 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.97 -42.87 99.18 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -40.5 83.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.22 -46.03 92.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.63 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 15.4 m-30 -60.51 -42.65 96.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.729 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.73 -37.68 88.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.709 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.6 t -63.62 -51.82 65.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -60.56 -37.87 82.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.606 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.2 mmt-85 -65.23 -41.24 94.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.383 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.9 mmt -64.09 -46.83 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.462 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.466 ' CD1' HD21 ' A' ' 42' ' ' LEU . 13.0 t80 -59.59 -37.79 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.043 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -74.71 -44.76 48.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.563 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -55.15 5.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.151 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -75.21 -20.78 59.09 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.409 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 1.3 mmt 61.11 20.15 10.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.68 0.276 . . . . 0.0 110.7 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -104.73 120.68 41.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.91 0.386 . . . . 0.0 110.864 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.42 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 44.5 t -79.67 -16.61 13.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.21 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.51 -28.45 56.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.879 0.371 . . . . 0.0 110.947 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.2 t -73.18 -45.25 54.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.751 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.466 HD21 ' CD1' ' A' ' 33' ' ' TYR . 2.4 pp -67.92 -38.6 83.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.751 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 71.2 t -61.03 -38.99 80.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.003 0.43 . . . . 0.0 110.372 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.71 -59.19 8.47 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.157 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -60.53 -45.03 95.33 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.781 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 59' ' ' PHE . 12.9 mt -50.81 -44.48 59.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.2 tppt? -57.91 -46.61 84.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.567 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.09 -37.64 64.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.736 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 p -100.97 2.87 10.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.468 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.571 HG12 ' HB2' ' A' ' 58' ' ' LEU . 53.2 mt -139.13 29.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.406 0.622 . . . . 0.0 110.955 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.478 ' N ' ' O ' ' A' ' 47' ' ' LYS . 28.6 p30 -86.28 17.65 3.59 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.873 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.416 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 24.2 mm-40 -126.03 141.22 38.94 Favored Pre-proline 0 N--CA 1.458 -0.05 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.439 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -45.42 -38.9 16.24 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.157 1.905 . . . . 0.0 111.884 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.2 t -69.4 -36.03 76.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.851 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.516 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 61.0 mtt85 -87.82 -15.73 36.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.768 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.644 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 15.8 mt -46.54 -51.92 33.35 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.644 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.0 Cg_exo -39.13 -29.17 0.18 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.358 2.706 . . . . 0.0 113.739 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HB2' HG12 ' A' ' 50' ' ' ILE . 1.0 OUTLIER -60.61 -30.14 69.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.821 0.344 . . . . 0.0 111.041 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.429 ' CE1' ' HB3' ' A' ' 46' ' ' LEU . 2.0 m-85 -69.61 -40.32 76.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 7.1 m-20 -75.28 -31.07 60.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.937 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.486 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -68.93 -61.85 1.63 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.047 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.34 -36.17 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.968 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.434 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 17.9 ttp180 -41.35 -66.68 0.37 Allowed Pre-proline 0 CA--C 1.538 0.487 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.11 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 88.9 Cg_exo -34.55 -33.62 0.08 OUTLIER 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.309 2.673 . . . . 0.0 113.497 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.436 HD12 ' CE2' ' A' ' 9' ' ' PHE . 6.8 mt -64.77 -53.59 44.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 110.141 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.493 HG21 ' HB2' ' A' ' 70' ' ' HIS . 0.6 OUTLIER -38.74 128.89 1.15 Allowed Pre-proline 0 CA--C 1.537 0.463 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.647 179.595 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.08 165.7 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.687 2.258 . . . . 0.0 112.251 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.9 mt -52.21 -51.28 59.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.264 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -57.89 -60.11 4.22 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.218 0.532 . . . . 0.0 110.387 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.493 ' HB2' HG21 ' A' ' 66' ' ' ILE . 18.5 m170 -60.12 -19.87 55.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.618 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.21 -53.55 29.19 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.425 HG11 ' N ' ' A' ' 73' ' ' GLU . 7.4 p -61.65 -35.26 66.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.248 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.425 ' N ' HG11 ' A' ' 72' ' ' VAL . 12.0 tp10 -70.92 -42.99 69.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.088 179.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -63.94 -44.46 92.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.232 179.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -39.72 85.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.396 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -59.22 -48.92 79.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.323 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 mt -62.72 -32.33 73.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.596 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.7 p -88.02 155.63 52.4 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.798 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -57.6 107.48 0.3 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.542 2.161 . . . . 0.0 112.223 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.038 -179.957 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 69.3 p -138.06 67.92 1.41 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.974 0.416 . . . . 0.0 110.861 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.0 mt -61.23 -48.39 81.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.836 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.487 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.3 OUTLIER -51.76 -53.03 44.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -60.48 -31.81 70.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.777 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.56 -40.04 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.76 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.41 HG22 ' CD1' ' A' ' 65' ' ' LEU . 9.4 t -71.06 -40.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.856 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 1.1 mt -63.33 -45.7 90.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.035 0.445 . . . . 0.0 109.981 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -60.39 -38.69 84.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.466 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -60.93 -41.96 97.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.572 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.425 ' CZ ' ' HG2' ' A' ' 10' ' ' ARG . 3.4 m-85 -70.18 -48.46 57.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.682 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 13.6 mt -51.35 -39.75 57.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.769 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 14.3 mtt-85 -76.75 -36.31 57.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.488 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.96 -9.33 57.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.539 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -78.5 -77.82 0.16 Allowed 'General case' 0 N--CA 1.457 -0.092 0 CA-C-O 120.857 0.36 . . . . 0.0 110.869 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.5 mttp . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.979 179.921 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.4 mtt . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.869 0.366 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -161.56 177.83 9.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.927 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.36 -36.45 76.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.74 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -65.0 -35.41 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.2 t -61.75 -35.05 65.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.202 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.69 -50.97 46.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.209 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.433 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 2.8 ttp180 -63.9 -26.84 68.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.422 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.73 -49.32 48.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.66 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.6 -43.36 72.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' HG3' ' CZ ' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -56.63 -44.76 81.57 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.933 178.401 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.4 t-160 -58.24 -42.75 87.03 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 109.817 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -59.62 -32.96 70.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.199 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.413 ' O ' ' N ' ' A' ' 17' ' ' ILE . 44.9 t -64.57 -47.58 88.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.58 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -57.6 -41.07 80.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.382 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.97 -31.42 70.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.742 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -101.4 8.96 41.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.611 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.423 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.4 mm -149.06 69.04 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-O 121.701 0.763 . . . . 0.0 110.148 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.81 -36.13 76.11 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.789 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -63.79 150.17 45.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.672 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -86.89 -30.18 21.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.091 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.61 -52.63 63.57 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.004 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -50.88 -34.7 29.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 82.2 mttt -72.74 -34.27 66.92 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.89 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.1 -45.5 88.38 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.153 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -62.49 -42.81 99.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.158 179.308 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.18 -40.99 82.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.441 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 13.4 m-30 -61.01 -43.03 99.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.293 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -68.61 -36.69 79.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.608 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.6 t -64.56 -50.43 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.705 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HB3' ' CD2' ' B' ' 105' ' ' LEU . 18.0 mt -60.62 -40.66 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.514 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.71 -39.07 87.18 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.329 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.6 mmt -60.71 -52.08 66.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.349 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.513 ' O ' ' HA ' ' A' ' 37' ' ' MET . 8.7 t80 -53.53 -40.82 65.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.323 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -74.39 -38.2 63.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.86 0.362 . . . . 0.0 111.354 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -54.87 5.89 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -86.22 -25.56 25.54 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.513 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.4 mmt 61.56 35.11 17.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 110.655 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -114.97 124.56 51.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.849 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 15.8 t -76.74 -12.64 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.192 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.15 -36.05 55.58 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 120.948 0.404 . . . . 0.0 110.287 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.8 t -70.13 -34.93 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.129 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.482 ' CD1' ' CG ' ' A' ' 33' ' ' TYR . 7.3 mt -66.61 -49.18 67.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.585 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.2 t -58.15 -37.48 62.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.073 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.26 -59.58 8.74 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.826 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.07 -42.93 79.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.889 0.376 . . . . 0.0 111.21 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' A' ' 50' ' ' ILE . 41.7 mt -50.45 -47.53 56.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -58.27 -45.23 88.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 mt -53.21 -40.88 64.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.8 p -101.08 4.22 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.449 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.568 HG12 ' HB2' ' A' ' 58' ' ' LEU . 60.0 mt -140.2 29.55 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.217 0.532 . . . . 0.0 111.219 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.481 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.4 p30 -89.2 15.73 8.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.628 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -129.59 150.12 74.8 Favored Pre-proline 0 C--N 1.333 -0.132 0 C-N-CA 121.126 -0.229 . . . . 0.0 110.491 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.68 -38.69 66.61 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.325 2.017 . . . . 0.0 111.429 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 t -69.42 -36.8 77.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.608 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.446 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 53.5 mtt85 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.647 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.673 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.1 mt -53.45 -49.78 86.55 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.673 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.7 Cg_endo -41.16 -27.91 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.022 2.482 . . . . 0.0 113.493 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.568 ' HB2' HG12 ' A' ' 50' ' ' ILE . 6.7 mt -70.74 -35.27 72.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.782 0.325 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.403 ' CD2' ' OH ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -58.04 -44.73 87.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.265 179.325 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.2 OUTLIER -75.31 -31.08 60.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.675 179.512 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.483 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -62.31 -59.85 4.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.408 HG13 ' CD1' ' A' ' 65' ' ' LEU . 0.1 OUTLIER -60.52 -38.04 76.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.34 -179.241 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.453 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -38.13 -66.29 0.31 Allowed Pre-proline 0 N--CA 1.469 0.476 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.772 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 82.3 Cg_exo -38.69 -32.12 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.835 2.357 . . . . 0.0 113.512 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.507 HD12 HG23 ' B' ' 104' ' ' VAL . 19.4 mt -65.44 -46.47 79.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.656 0.741 . . . . 0.0 109.851 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.452 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -54.52 133.47 63.4 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.18 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.74 165.56 0.73 Allowed 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.496 2.131 . . . . 0.0 112.168 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.2 tp -56.59 -57.09 13.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.979 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -57.86 -52.17 66.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.117 0.485 . . . . 0.0 110.388 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.452 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.26 -43.5 98.7 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.188 179.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.8 -45.87 97.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.118 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.14 93.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.072 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.403 ' OH ' ' CD2' ' A' ' 59' ' ' PHE . 53.5 t80 -59.85 -40.34 88.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.324 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.94 -53.39 57.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.561 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -66.71 -15.45 63.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.266 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 mt -91.96 -20.8 21.0 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.541 ' N ' ' CD ' ' A' ' 79' ' ' PRO . 7.4 p -56.89 -39.22 76.35 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.541 ' CD ' ' N ' ' A' ' 78' ' ' THR . 52.1 Cg_exo -55.1 -50.62 12.52 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.026 1.817 . . . . 0.0 112.286 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.769 -0.132 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.1 m 63.24 90.56 0.08 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.924 0.392 . . . . 0.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt -93.93 -28.5 15.78 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.005 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.4 OUTLIER -52.02 -39.47 59.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.843 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.421 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 28.2 ttpp -61.01 -42.46 98.5 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.598 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.23 -38.48 83.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.897 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.507 HG23 HD12 ' A' ' 65' ' ' LEU . 23.8 t -68.03 -37.08 77.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.362 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -61.92 -44.06 97.56 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 178.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.51 -36.82 84.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.606 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -60.03 -40.32 88.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.43 ' CZ ' ' HG3' ' A' ' 10' ' ' ARG . 4.8 m-85 -73.53 -45.71 52.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.78 179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 5.8 mt -51.01 -41.64 59.9 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.565 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -76.89 -34.32 57.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.119 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.4 -18.1 60.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.184 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -87.7 -47.05 8.96 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 121.004 0.43 . . . . 0.0 110.879 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.818 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.795 0.331 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -132.43 31.64 4.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.89 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.1 ttt-85 -83.56 -31.89 26.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.959 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -35.43 81.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.39 -40.13 85.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.99 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.78 -50.95 54.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -66.15 -26.9 67.64 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.12 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -71.69 -48.93 44.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.408 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.536 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.5 -43.02 73.98 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.089 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -43.3 90.17 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.664 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 17.3 t-160 -57.27 -42.26 81.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.866 178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -59.32 -36.81 76.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.157 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.2 t -60.24 -46.68 94.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.315 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -57.6 -41.48 81.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.153 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.0 -31.77 70.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.603 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.5 mt -97.18 6.03 49.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.406 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.431 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.5 mm -145.32 67.78 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 121.721 0.772 . . . . 0.0 110.029 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.64 -33.81 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.927 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.48 165.8 13.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.654 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -101.65 -32.97 10.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.985 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.19 74.37 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.77 -34.57 27.8 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 36.5 mttt -72.91 -34.82 66.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.897 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -63.78 -42.69 97.71 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.227 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.83 -45.16 87.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.209 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.9 mt -60.66 -38.98 86.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.501 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.7 m-85 -61.34 -44.63 96.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.588 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.68 -33.96 77.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.597 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.402 ' CG1' ' HA ' ' A' ' 42' ' ' LEU . 42.3 t -65.52 -47.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.796 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.84 -42.71 99.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.661 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.18 -40.87 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.493 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -47.02 86.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.144 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.475 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 4.9 t80 -55.58 -46.45 77.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.875 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -74.9 -33.63 62.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.578 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -77.3 -55.05 5.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.9 p -89.51 -10.82 44.83 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.439 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.8 mmt 59.63 24.51 13.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.731 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -101.09 117.44 35.03 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.975 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.409 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 21.3 t -79.86 -21.93 11.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.009 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.61 -28.43 56.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.766 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.7 t -73.46 -44.19 54.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.759 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.475 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 2.4 pp -68.4 -38.39 81.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.74 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.432 HG23 ' CD2' ' A' ' 74' ' ' TYR . 91.5 t -63.95 -42.28 95.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.336 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.81 -58.36 14.63 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.165 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.54 -40.17 90.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.975 0.417 . . . . 0.0 110.709 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.422 ' O ' ' N ' ' A' ' 50' ' ' ILE . 12.3 mt -51.9 -43.19 63.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.608 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.473 ' O ' ' N ' ' A' ' 51' ' ' ASN . 1.6 tppt? -57.9 -47.48 82.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.14 0.495 . . . . 0.0 110.514 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.25 -36.39 63.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.71 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.9 p -101.22 2.25 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.553 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.56 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 53.4 mt -140.15 29.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-O 121.29 0.566 . . . . 0.0 110.869 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.473 ' N ' ' O ' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -87.24 17.59 4.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.966 -179.869 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -128.36 142.2 43.9 Favored Pre-proline 0 CA--C 1.523 -0.07 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.54 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -46.75 -38.26 22.38 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.148 1.899 . . . . 0.0 111.498 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -35.66 76.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.583 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.56 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 18.9 mtt85 -90.83 -7.22 52.91 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.808 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.49 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.3 mt -57.15 -46.02 99.88 Favored Pre-proline 0 CA--C 1.531 0.244 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.49 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 91.2 Cg_exo -43.77 -26.76 1.33 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.766 2.31 . . . . 0.0 113.729 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HB2' HG12 ' A' ' 50' ' ' ILE . 8.5 mt -73.44 -30.29 63.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.757 0.313 . . . . 0.0 111.015 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.465 ' CZ ' ' HD3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -60.99 -48.45 81.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.618 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.442 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.9 OUTLIER -75.19 -31.0 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.77 179.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.47 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -60.73 -58.2 9.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.776 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.92 -36.85 77.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.957 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.429 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 1.1 ttp85 -36.5 -62.82 0.49 Allowed Pre-proline 0 N--CA 1.469 0.489 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.465 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.6 Cg_exo -33.97 -36.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.406 2.737 . . . . 0.0 113.545 -179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.463 ' CD1' HG23 ' B' ' 104' ' ' VAL . 15.2 mt -65.09 -56.8 10.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.413 0.625 . . . . 0.0 109.951 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.414 HG22 ' HB2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -44.24 133.65 4.4 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.187 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -50.94 165.34 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.607 2.205 . . . . 0.0 112.437 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.98 -55.38 33.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.05 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -57.52 -53.97 52.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.178 0.513 . . . . 0.0 110.342 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.414 ' HB2' HG22 ' A' ' 66' ' ' ILE . 44.5 m170 -60.99 -22.22 64.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.482 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.11 -54.93 16.78 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.974 0.416 . . . . 0.0 110.454 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.444 HG12 ' N ' ' A' ' 73' ' ' GLU . 7.4 p -59.18 -35.11 55.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.183 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.444 ' N ' HG12 ' A' ' 72' ' ' VAL . 4.1 tp10 -68.47 -37.37 80.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.968 178.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.432 ' CD2' HG23 ' A' ' 43' ' ' VAL . 9.5 t80 -63.34 -37.91 89.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.216 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.21 -43.46 86.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.621 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -66.61 -26.67 67.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.22 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.6 mt -86.96 -25.68 24.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.933 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.627 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 66.7 p -55.28 -45.27 99.88 Favored Pre-proline 0 CA--C 1.534 0.337 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.627 ' HD2' ' N ' ' A' ' 78' ' ' THR . 23.2 Cg_endo -60.58 162.41 18.09 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.928 1.752 . . . . 0.0 112.257 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.911 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m 61.68 29.29 18.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.8 0.334 . . . . 0.0 111.074 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 10.9 mt -90.29 -29.05 18.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.972 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.463 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 53.2 tp -51.77 -52.76 46.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.459 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -57.15 -31.57 65.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.595 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.22 -40.26 95.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.463 HG23 ' CD1' ' A' ' 65' ' ' LEU . 2.0 t -70.94 -36.17 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.929 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.3 OUTLIER -72.0 -45.51 60.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.847 0.356 . . . . 0.0 110.484 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -70.06 -33.82 72.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.774 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -64.74 -45.36 86.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.756 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -50.66 45.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.735 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.406 ' O ' ' HG2' ' B' ' 112' ' ' LYS . 55.2 mt -51.06 -40.68 58.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.472 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -77.46 -35.72 53.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.273 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -21.98 51.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.136 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . 0.426 ' H ' ' HG2' ' B' ' 112' ' ' LYS . 0.0 OUTLIER -100.98 -29.73 12.03 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.029 179.384 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.6 mttp . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.917 179.976 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.7 mtp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.795 0.331 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 61.12 110.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.877 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.7 mtt85 -160.96 -43.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.975 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -33.58 71.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.514 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.04 -39.3 71.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.1 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.408 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -67.09 -50.91 60.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -64.91 -26.9 68.51 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.188 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -70.61 -49.12 51.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.526 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.518 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.75 -43.57 72.0 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.083 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.429 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 0.1 OUTLIER -58.93 -41.82 88.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.736 178.488 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 -58.7 -42.3 88.27 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.784 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -59.91 -36.0 76.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.01 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.0 t -60.5 -49.09 85.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.519 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -57.63 -38.74 75.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.308 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.95 -35.3 76.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.421 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.2 mt -95.25 5.44 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.46 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 40.5 mm -147.61 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 121.611 0.719 . . . . 0.0 110.224 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -56.42 -39.72 73.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.891 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.17 179.17 0.15 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.681 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -111.44 -32.26 6.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.2 -53.02 62.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -50.81 -35.04 30.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 7.2 mttt -73.25 -34.26 65.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.904 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.48 -41.27 98.57 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.08 -46.07 82.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.218 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.55 -36.6 78.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.607 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.8 m-85 -62.83 -44.86 95.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.615 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.2 -40.55 90.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.548 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.416 HG12 ' CD2' ' A' ' 42' ' ' LEU . 22.2 t -60.29 -47.88 90.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.921 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.8 mt -59.87 -44.71 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.45 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -32.99 69.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.348 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.445 ' O ' ' N ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -64.48 -55.36 21.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.283 179.563 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.431 ' CG ' HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -53.45 -34.45 57.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -74.85 -53.38 9.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.523 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.27 -55.18 5.64 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' MET . 17.8 p -86.67 -47.64 8.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.658 0.266 . . . . 0.0 111.583 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 75.45 32.41 0.72 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.863 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.24 120.19 39.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.749 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.3 t -78.22 -16.54 13.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.252 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -36.55 53.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.99 0.424 . . . . 0.0 110.327 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.3 t -72.81 -34.17 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.018 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' CG ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -67.9 -44.31 77.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.89 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 59.5 t -57.46 -40.0 72.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.816 0.341 . . . . 0.0 110.925 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.49 -57.68 10.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.757 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.61 -48.91 75.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.999 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 51.2 mt -50.48 -44.45 55.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.016 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.39 -46.64 89.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.094 0.473 . . . . 0.0 110.463 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mt -51.98 -37.63 53.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.699 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.8 p -101.11 1.74 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.454 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.595 HG12 ' HB2' ' A' ' 58' ' ' LEU . 58.3 mt -135.13 27.41 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.304 0.573 . . . . 0.0 111.136 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 23.2 m-20 -84.39 12.08 7.4 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.885 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -126.29 145.41 52.53 Favored Pre-proline 0 C--O 1.231 0.11 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.767 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -47.95 -38.81 31.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.318 2.012 . . . . 0.0 111.692 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 p -69.27 -35.94 76.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.545 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.435 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 63.3 mtt85 -88.02 -8.55 55.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.636 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.627 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 16.6 mt -55.43 -53.48 61.71 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.531 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.627 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.2 Cg_exo -39.04 -29.19 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.362 2.708 . . . . 0.0 113.641 -179.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.595 ' HB2' HG12 ' A' ' 50' ' ' ILE . 35.7 mt -60.94 -37.03 80.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.425 ' CD2' HG23 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -60.96 -44.1 97.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.585 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.447 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.9 m-20 -75.0 -31.18 61.34 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.647 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 9' ' ' PHE . . . -63.82 -62.31 1.73 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.752 -179.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -35.06 71.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.055 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.453 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 5.8 ttt-85 -38.05 -65.32 0.38 Allowed Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.453 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 76.7 Cg_exo -36.16 -33.7 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 123.084 2.523 . . . . 0.0 113.406 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.441 HD12 ' CZ ' ' A' ' 9' ' ' PHE . 16.5 mt -65.14 -51.68 59.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.349 0.595 . . . . 0.0 110.128 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.437 HG22 ' HB2' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -45.08 132.15 5.47 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.351 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.493 ' HG2' ' HB2' ' A' ' 70' ' ' HIS . 2.8 Cg_endo -48.25 165.68 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.61 2.206 . . . . 0.0 112.123 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.1 tp -55.39 -56.12 23.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.419 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.1 pttt -56.3 -52.62 63.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.493 ' HB2' ' HG2' ' A' ' 67' ' ' PRO . 25.0 m170 -62.88 -29.19 70.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.477 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.03 -43.88 87.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.016 0.436 . . . . 0.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 t -67.85 -47.76 78.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.269 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.81 -27.9 69.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.508 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -69.37 -48.32 61.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.694 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -60.99 -39.01 88.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.631 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -61.97 -47.28 85.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.776 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 23.3 mt -68.02 -34.8 77.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.955 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.4 p -74.36 154.48 88.02 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.932 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -64.65 98.35 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.475 2.117 . . . . 0.0 112.323 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.848 179.995 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 112.548 -0.221 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -125.92 30.68 5.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.771 0.32 . . . . 0.0 110.937 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.3 mt -131.54 -40.84 1.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.187 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.408 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 40.5 tp -51.92 -52.62 48.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.99 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.415 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.0 OUTLIER -54.99 -35.35 64.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.923 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.04 -38.57 91.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.429 HG12 ' CZ ' ' A' ' 9' ' ' PHE . 24.1 t -69.8 -34.24 59.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.102 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.415 ' HG ' ' HA ' ' B' ' 102' ' ' LYS . 1.1 mt -64.44 -45.61 86.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.957 0.408 . . . . 0.0 109.959 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -35.19 80.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.566 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -62.63 -39.15 92.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.575 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.429 ' CE2' ' HG3' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -71.05 -52.9 16.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.737 179.767 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 11.6 mt -51.02 -35.7 35.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.769 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -76.89 -36.22 56.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.175 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.03 -10.66 60.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.293 178.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 27.5 mmtt -79.48 -54.28 6.07 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.02 0.438 . . . . 0.0 110.762 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.963 179.913 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.98 0.419 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.443 ' O ' ' HB2' ' A' ' 3' ' ' ARG . 3.7 m-20 -142.91 149.84 39.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.821 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.443 ' HB2' ' O ' ' A' ' 2' ' ' ASP . 0.9 OUTLIER 68.76 -57.22 0.51 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.643 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -34.75 72.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.811 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.42 -37.58 80.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.4 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -69.04 -49.84 53.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.717 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -26.71 68.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.335 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -70.06 -49.31 52.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.449 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.522 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.86 -42.54 73.38 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.433 ' HD2' ' CD2' ' B' ' 108' ' ' TYR . 22.1 ttp85 -57.47 -44.1 84.6 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.664 178.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 18.3 t-160 -57.8 -43.33 85.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.209 0.528 . . . . 0.0 109.789 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -59.18 -35.23 73.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.193 179.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.411 ' O ' ' N ' ' A' ' 17' ' ' ILE . 61.5 t -62.05 -46.65 96.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.271 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -57.59 -39.3 76.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.005 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -69.07 -36.1 77.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.541 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.6 mt -96.49 8.39 44.21 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.572 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.419 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 34.5 mm -150.06 69.53 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-O 121.625 0.726 . . . . 0.0 109.986 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.85 -33.52 70.53 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.03 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -60.89 175.47 0.49 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -110.26 -30.44 7.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.71 -51.23 63.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.973 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -50.78 -34.69 28.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 73.4 mttt -72.14 -35.5 69.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.003 178.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.45 -40.66 97.35 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.049 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.304 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.71 -38.62 78.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.56 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 14.1 m-30 -64.73 -45.43 86.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.7 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.74 -38.04 89.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.886 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 36.3 t -63.0 -50.71 78.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.016 0.436 . . . . 0.0 110.952 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.417 ' CD2' ' CD1' ' A' ' 62' ' ' ILE . 13.0 mt -62.71 -40.41 97.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.483 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -65.36 -40.55 93.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.4 tpt -62.21 -44.85 95.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.371 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CG ' ' CD2' ' A' ' 42' ' ' LEU . 6.3 t80 -57.45 -45.09 85.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.017 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -74.59 -33.67 62.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -55.0 5.8 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -82.33 -19.8 38.63 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 3.7 mmt 63.36 26.82 15.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.883 0.373 . . . . 0.0 110.652 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -114.06 121.39 43.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.412 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 22.0 t -78.38 -16.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.238 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.78 54.79 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.915 0.388 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.53 -43.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.793 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.468 ' CD2' ' CG ' ' A' ' 33' ' ' TYR . 3.4 pp -69.01 -38.28 79.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.629 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.433 HG22 ' CD2' ' A' ' 74' ' ' TYR . 79.5 t -61.56 -44.34 98.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.942 0.401 . . . . 0.0 110.377 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.31 -58.89 11.69 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.243 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -39.32 87.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.819 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 50' ' ' ILE . 12.0 mt -52.35 -45.02 65.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -57.36 -48.63 78.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.337 179.469 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.07 -39.46 56.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.873 179.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 p -100.94 4.93 10.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.42 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.538 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 62.3 mt -138.34 27.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.257 0.551 . . . . 0.0 110.868 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 47' ' ' LYS . 22.5 m-20 -84.69 12.59 6.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.835 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -125.37 148.31 60.71 Favored Pre-proline 0 C--N 1.334 -0.083 0 C-N-CA 121.13 -0.228 . . . . 0.0 110.552 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.79 -38.14 66.77 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.37 2.047 . . . . 0.0 111.466 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.6 p -69.54 -32.7 71.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.47 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.459 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 86.2 mtt180 -90.57 -11.46 39.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.572 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.486 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 14.5 mt -55.97 -45.91 99.83 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.675 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.486 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.9 Cg_exo -44.32 -24.88 1.1 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.786 2.324 . . . . 0.0 113.532 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.475 ' HB2' HG12 ' A' ' 50' ' ' ILE . 6.9 mt -73.12 -35.35 66.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.747 0.308 . . . . 0.0 110.984 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.06 -46.04 89.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 0.0 110.751 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.433 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.3 m-20 -75.04 -30.95 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.85 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.508 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -64.96 -63.39 1.12 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.984 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.417 ' CD1' ' CD2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -59.03 -37.42 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.457 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.7 mtm180 -38.45 -66.39 0.31 Allowed Pre-proline 0 N--CA 1.468 0.444 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.457 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 79.3 Cg_exo -37.05 -30.69 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.214 2.609 . . . . 0.0 113.54 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.437 HD13 ' CE2' ' A' ' 9' ' ' PHE . 16.2 mt -65.18 -49.82 68.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.524 0.678 . . . . 0.0 109.651 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.447 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -53.07 138.42 46.12 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.744 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -48.34 165.46 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.691 2.26 . . . . 0.0 112.427 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 tp -56.93 -57.11 13.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.967 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -57.13 -53.59 56.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.129 0.49 . . . . 0.0 110.251 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 24.1 m170 -59.21 -28.73 66.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.451 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.31 -42.23 93.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.3 t -62.89 -42.78 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.497 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -64.46 -45.68 86.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.341 179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.433 ' CD2' HG22 ' A' ' 43' ' ' VAL . 8.5 t80 -59.77 -44.71 93.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.375 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.543 ' O ' ' HD3' ' A' ' 79' ' ' PRO . 0.1 OUTLIER -60.28 -46.61 89.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.824 179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -67.13 -21.85 65.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.661 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.8 mt -84.53 -29.65 25.76 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.573 ' OG1' ' HD3' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -58.33 -49.35 94.06 Favored Pre-proline 0 N--CA 1.465 0.322 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.607 -178.762 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.573 ' HD3' ' OG1' ' A' ' 78' ' ' THR . 69.5 Cg_endo -94.35 -166.41 0.13 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.986 2.457 . . . . 0.0 112.697 -179.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.54 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 6.2 m -64.02 128.56 36.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.834 0.35 . . . . 0.0 110.972 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.7 mt -129.37 -44.19 1.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.999 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 2.6 pt? -51.81 -43.84 63.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.848 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.441 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 8.6 tttp -59.34 -33.91 71.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.382 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -68.1 -36.45 79.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.56 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.4 ' CG2' ' CB ' ' A' ' 6' ' ' ALA . 22.9 t -68.37 -34.15 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.868 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.8 OUTLIER -68.4 -45.55 72.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.423 179.451 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.32 -39.87 92.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -61.7 -40.15 94.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.648 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.433 ' CD2' ' HD2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.14 -47.07 47.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.75 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 9.8 mt -51.31 -40.07 58.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.874 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -76.73 -37.35 56.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.569 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.69 -6.1 44.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.721 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -94.28 -77.61 0.46 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.968 0.413 . . . . 0.0 110.955 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.864 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.1 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.875 0.369 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -126.17 -44.28 1.75 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.965 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -120.08 -37.6 3.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.998 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.4 -37.97 79.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.008 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t -58.07 -42.5 83.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.208 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.403 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -65.33 -50.95 63.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.995 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -26.79 69.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.315 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -70.12 -49.11 54.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.591 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.523 ' CD1' ' HB3' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.4 -42.67 71.35 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 179.012 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' HD3' ' CE2' ' B' ' 108' ' ' TYR . 6.8 tmm_? -58.44 -42.04 86.47 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.656 178.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.06 -46.15 88.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.453 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.402 ' HG2' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -60.38 -31.72 70.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.403 179.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.423 HG23 ' HA ' ' A' ' 10' ' ' ARG . 47.6 t -63.64 -48.05 88.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.36 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.62 -41.31 81.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -69.15 -35.23 76.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.315 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.2 mt -93.38 6.95 46.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.525 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.427 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 39.1 mm -142.31 66.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-O 121.782 0.801 . . . . 0.0 109.98 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -51.43 -31.57 23.5 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.044 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.73 170.66 11.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.719 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.01 -30.13 9.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.95 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.96 -50.26 72.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.014 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -50.72 -34.59 27.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.36 0.6 . . . . 0.0 109.397 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 33.6 mttt -71.75 -35.59 70.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.935 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.49 -42.55 99.57 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.19 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.72 -44.6 89.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.403 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.52 -36.51 76.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.711 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 12.8 m-30 -64.19 -48.52 75.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.617 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.32 -38.64 80.8 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.784 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 t -60.86 -52.54 60.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.08 0.467 . . . . 0.0 110.793 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 28.5 mt -59.58 -42.97 93.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.317 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.98 -36.71 70.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.465 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 1.8 mmt -63.56 -48.37 77.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.105 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.512 ' O ' ' HA ' ' A' ' 37' ' ' MET . 0.1 OUTLIER -53.39 -39.44 64.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.0 179.634 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -74.85 -46.13 38.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.84 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.465 ' HG2' ' HA ' ' A' ' 32' ' ' MET . 7.4 pt20 -77.54 -52.68 8.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -178.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.4 p -92.78 -31.76 14.92 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.512 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 4.7 mmt 63.77 31.19 14.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.979 0.419 . . . . 0.0 110.79 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -104.87 118.51 36.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.6 t -77.95 -14.61 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.463 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.07 -34.07 59.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 110.324 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.3 t -72.61 -37.76 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.203 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.416 HD12 ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -65.24 -44.41 88.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.937 179.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 56.5 t -54.56 -43.66 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-O 120.796 0.332 . . . . 0.0 111.2 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.38 -56.41 15.64 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.688 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.43 -52.19 66.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.866 0.365 . . . . 0.0 111.1 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' A' ' 50' ' ' ILE . 0.7 OUTLIER -50.42 -45.01 55.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.073 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.47 ' O ' ' N ' ' A' ' 51' ' ' ASN . 6.0 mttp -57.62 -48.39 79.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.118 0.485 . . . . 0.0 110.704 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.8 mt -54.1 -37.56 64.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.876 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.4 p -101.04 3.47 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.332 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.536 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 61.4 mt -139.18 27.86 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-O 121.305 0.574 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.47 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -88.6 16.86 6.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.72 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -128.94 142.87 46.59 Favored Pre-proline 0 C--N 1.335 -0.046 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.579 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -45.68 -39.16 17.88 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.254 1.97 . . . . 0.0 111.927 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -69.12 -34.84 75.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.719 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.491 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 46.8 mtt85 -91.78 -9.71 42.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.91 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.491 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.5 mt -55.28 -46.12 99.74 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.651 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.47 -25.69 2.34 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.78 2.32 . . . . 0.0 113.523 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.521 ' HB2' HG12 ' A' ' 50' ' ' ILE . 3.4 mt -73.81 -34.15 64.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.85 0.357 . . . . 0.0 111.03 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -59.93 -50.86 72.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.436 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 5.0 t0 -75.2 -31.16 60.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.523 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -60.85 -53.67 54.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.052 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -66.15 -36.78 78.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.906 0.384 . . . . 0.0 111.75 -179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.402 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -35.51 -61.24 0.54 Allowed Pre-proline 0 N--CA 1.469 0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.294 -179.234 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 75.8 Cg_exo -34.75 -33.98 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.511 2.807 . . . . 0.0 113.467 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' A' ' 9' ' ' PHE . 15.1 mt -65.2 -53.97 36.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.596 0.712 . . . . 0.0 109.525 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.421 HG22 ' HB2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -46.41 136.64 7.13 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.135 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -67.18 165.7 25.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.448 2.098 . . . . 0.0 112.028 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.9 tp -51.13 -50.37 59.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.174 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -58.43 8.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.919 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.421 ' HB2' HG22 ' A' ' 66' ' ' ILE . 18.2 m170 -62.05 -25.79 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.397 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.28 -42.33 99.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.017 0.437 . . . . 0.0 110.047 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 35.1 t -67.74 -44.74 85.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.424 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -67.22 -33.76 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.408 ' OH ' ' CD2' ' A' ' 59' ' ' PHE . 50.8 t80 -64.89 -39.29 93.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.328 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -67.87 -42.32 81.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.797 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -66.76 -27.32 67.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.349 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.3 mt -86.61 -25.86 24.71 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.639 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 71.7 p -55.51 -45.11 99.92 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.639 ' HD2' ' N ' ' A' ' 78' ' ' THR . 18.5 Cg_endo -58.62 164.19 9.75 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 121.979 1.786 . . . . 0.0 112.325 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.94 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 19.3 m -91.16 -26.33 19.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.768 0.318 . . . . 0.0 110.958 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.28 -29.84 58.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.05 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 3.3 tp -56.18 -52.62 63.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.986 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -63.07 -31.56 72.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.879 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.24 -44.66 91.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.323 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.403 ' CG2' ' CB ' ' A' ' 6' ' ' ALA . 24.7 t -66.08 -54.2 29.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.227 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 4.4 pp -61.75 -32.88 73.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -73.96 -40.35 63.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.717 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -61.36 -35.64 78.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.43 ' CE2' ' HD3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -74.23 -51.09 16.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.2 0.524 . . . . 0.0 110.492 179.632 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 32.7 mt -51.16 -37.5 46.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.459 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . 0.408 ' HG3' ' N ' ' B' ' 111' ' ' LEU . 2.1 ptp180 -76.98 -35.69 56.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.197 179.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . 0.408 ' N ' ' HG3' ' B' ' 110' ' ' ARG . 0.1 OUTLIER -64.06 -16.96 62.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.063 178.867 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 10.5 mmmt -100.26 -39.72 7.89 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.838 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.822 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.823 0.344 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -100.22 137.41 38.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.967 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.66 -35.11 7.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.78 -34.24 71.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.765 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -66.44 -35.1 74.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.75 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.402 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -70.01 -50.26 43.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.975 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -26.78 68.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.249 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.53 -49.11 51.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.389 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.538 ' CD1' ' HB2' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.55 -43.99 71.82 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.058 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -59.07 -40.82 86.38 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.581 178.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -59.33 -42.49 91.58 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.831 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.6 mttp -60.39 -37.23 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.272 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.401 ' O ' ' N ' ' A' ' 17' ' ' ILE . 41.9 t -59.9 -48.93 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -57.62 -39.07 76.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.219 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -69.05 -32.45 71.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.481 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.0 mt -100.42 8.53 43.54 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.529 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.441 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 35.3 mm -147.02 68.52 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.702 0.763 . . . . 0.0 110.051 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -58.78 -33.37 70.24 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.891 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -72.72 139.15 47.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.742 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -75.46 -28.87 59.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.033 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -52.65 64.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.032 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -50.98 -34.76 30.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 17.7 mttp -72.21 -34.25 68.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.887 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -61.61 -41.8 97.98 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.188 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.76 -42.08 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.291 179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.5 mt -63.1 -39.01 93.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.532 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.401 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.7 m-85 -62.67 -44.48 96.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.63 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -63.5 -44.51 94.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.547 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.6 t -59.46 -46.49 92.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 mt -59.7 -44.41 93.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.426 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.86 -36.24 72.07 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.508 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.428 ' O ' ' N ' ' A' ' 36' ' ' THR . 25.8 mtp -63.35 -48.94 75.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.139 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.441 ' CE2' HG13 ' A' ' 66' ' ' ILE . 0.1 OUTLIER -53.54 -42.55 67.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.878 0.37 . . . . 0.0 110.883 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -44.55 49.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.869 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -77.34 -55.01 5.76 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.428 ' N ' ' O ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -92.2 -43.39 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -178.666 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.435 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.5 ttt 74.51 32.98 0.88 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.853 0.359 . . . . 0.0 110.652 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -98.14 115.92 29.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.555 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.412 ' CG2' ' ND1' ' A' ' 70' ' ' HIS . 20.8 t -79.2 -16.63 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.447 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.88 -37.68 47.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.017 0.437 . . . . 0.0 110.478 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 25.4 t -73.56 -34.06 40.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.279 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.424 HD12 ' CB ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -69.51 -41.37 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.803 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.406 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 95.0 t -60.0 -40.06 82.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.639 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.17 -57.27 12.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.449 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.55 -48.66 76.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.871 0.367 . . . . 0.0 110.908 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 50' ' ' ILE . 65.6 mt -50.52 -41.93 54.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.874 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -62.15 -44.94 95.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.105 0.478 . . . . 0.0 110.435 179.621 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -54.95 -37.05 65.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.76 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.0 p -101.12 -0.78 10.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.394 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.543 HG12 ' HB2' ' A' ' 58' ' ' LEU . 49.0 mt -136.64 29.46 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.083 0.468 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -89.31 16.53 7.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.674 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -131.01 143.7 50.52 Favored Pre-proline 0 C--N 1.333 -0.112 0 CA-C-O 120.561 0.22 . . . . 0.0 110.435 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -46.25 -39.49 21.19 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.343 2.029 . . . . 0.0 111.974 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 m -69.21 -33.55 73.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.624 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.441 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 11.2 mtp180 -89.87 -12.04 40.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.477 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.482 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 14.8 mt -53.78 -46.07 98.56 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 94.1 Cg_exo -43.72 -27.21 1.44 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.706 2.271 . . . . 0.0 113.736 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.543 ' HB2' HG12 ' A' ' 50' ' ' ILE . 14.9 mt -73.72 -34.23 64.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 111.139 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -45.84 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 110.888 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.32 -31.48 60.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.832 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.538 ' HB2' ' CD1' ' A' ' 9' ' ' PHE . . . -62.35 -63.06 1.35 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.732 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.71 -30.86 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.971 0.415 . . . . 0.0 111.648 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.498 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 25.1 ttp180 -40.18 -60.26 1.54 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.498 ' CD ' ' HB3' ' A' ' 63' ' ' ARG . 6.7 Cg_endo -48.76 -25.64 8.5 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.69 2.26 . . . . 0.0 113.28 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.463 HD12 ' CE2' ' A' ' 9' ' ' PHE . 26.1 mt -65.57 -45.25 84.02 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.568 0.699 . . . . 0.0 109.575 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.487 HG21 ' HB2' ' A' ' 70' ' ' HIS . 1.3 mp -50.7 136.43 25.65 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.149 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.415 ' O ' ' N ' ' A' ' 71' ' ' GLN . 21.3 Cg_endo -61.39 165.78 12.47 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.576 2.184 . . . . 0.0 112.188 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 16.8 mt -52.01 -49.76 62.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.467 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -56.75 -61.35 2.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.162 0.506 . . . . 0.0 110.681 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.487 ' HB2' HG21 ' A' ' 66' ' ' ILE . 16.0 m170 -60.23 -26.66 66.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 67' ' ' PRO . 1.8 mm-40 -60.81 -46.95 88.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.041 0.448 . . . . 0.0 109.896 179.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 20.0 t -62.23 -45.0 99.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.935 179.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.12 -31.35 72.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.32 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -63.06 -46.34 87.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.67 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.18 -42.07 96.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.672 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -59.92 -35.38 74.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.726 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.4 mt -85.7 -32.79 21.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.01 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 36.9 p -89.63 112.07 49.64 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.964 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.94 120.44 7.91 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.465 2.11 . . . . 0.0 112.189 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.857 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.24 -174.02 2.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.656 0.265 . . . . 0.0 110.914 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 2.7 mt 68.7 -61.06 0.42 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.253 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.429 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 26.3 tp -53.35 -52.75 58.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.959 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -56.68 -31.66 64.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -67.63 -38.41 83.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.977 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.402 ' CG2' ' CB ' ' A' ' 6' ' ' ALA . 23.9 t -70.85 -34.93 57.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.482 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.5 OUTLIER -67.26 -45.62 76.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.425 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -73.61 -33.71 64.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.726 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -58.7 -50.09 75.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.794 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -44.47 46.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.693 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' B' ' 112' ' ' LYS . 4.9 mt -51.43 -41.68 60.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.57 -40.8 41.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.009 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.23 -20.06 38.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.567 179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' B' ' 109' ' ' LEU . 0.0 OUTLIER -101.16 -23.37 14.46 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.204 179.629 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' B' ' 112' ' ' LYS . 10.9 mttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.19 -0.909 . . . . 0.0 110.915 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 ttm . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.793 0.33 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -110.07 31.26 6.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.932 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.7 -30.71 26.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.907 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -59.28 -33.52 71.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.9 t -61.61 -39.19 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.405 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -67.52 -50.96 56.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.183 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -66.68 -26.88 67.25 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.069 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -71.63 -48.93 44.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.372 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.538 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.32 -44.04 72.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.016 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' HG2' ' CE2' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -59.47 -41.13 89.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.838 178.673 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -58.46 -43.0 88.69 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.8 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -60.7 -35.47 76.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' ILE . 54.8 t -60.71 -48.46 88.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.465 179.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.62 -41.33 81.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.191 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -69.14 -32.61 72.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.472 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.7 mt -97.99 7.47 46.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.547 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.421 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 35.6 mm -146.59 68.63 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.931 0 CA-C-O 121.671 0.748 . . . . 0.0 109.861 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -55.92 -33.48 64.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.871 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -71.25 159.63 34.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.695 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.0 -29.78 15.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.975 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.54 -52.67 64.55 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -50.8 -34.77 28.93 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -72.88 -34.17 66.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.944 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -64.88 -44.67 88.92 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.249 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.8 -40.18 94.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.249 179.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -39.73 94.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.492 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -60.89 -43.57 98.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.481 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -64.81 -36.29 83.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.547 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.403 ' CG1' ' CD2' ' A' ' 42' ' ' LEU . 28.0 t -65.62 -45.41 92.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.407 ' HB3' ' CD2' ' B' ' 105' ' ' LEU . 12.9 mt -65.52 -43.3 90.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.522 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -63.63 -31.11 72.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.42 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -52.1 35.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.378 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.514 ' O ' ' HA ' ' A' ' 37' ' ' MET . 14.8 t80 -57.55 -33.88 68.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.996 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -74.57 -41.6 60.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.994 0.426 . . . . 0.0 111.018 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -77.45 -54.99 5.76 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.38 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 p -81.67 -28.79 33.37 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.514 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.0 mmt 64.13 35.46 10.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 110.607 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -118.21 124.23 47.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.7 t -77.63 -7.37 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.377 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -38.56 47.99 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.05 0.453 . . . . 0.0 110.269 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.25 -33.98 60.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.99 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.482 ' CD1' ' CG ' ' A' ' 33' ' ' TYR . 1.2 mt -66.82 -49.77 64.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.884 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 29.0 t -58.68 -42.87 86.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.477 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.35 -58.29 14.1 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.848 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -66.13 -40.9 91.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.258 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.442 ' O ' ' N ' ' A' ' 50' ' ' ILE . 20.7 mt -51.51 -47.44 63.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.096 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.48 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.76 -46.84 77.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 0.0 110.702 179.685 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.6 mt -53.57 -41.18 66.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.841 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.3 p -101.19 8.44 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.354 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 58' ' ' LEU . 71.2 mt -144.88 28.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.236 0.541 . . . . 0.0 111.094 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 47' ' ' LYS . 14.5 p30 -90.18 15.32 10.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.559 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -128.79 150.86 76.13 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.07 -39.21 70.75 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.38 2.053 . . . . 0.0 111.558 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.6 p -69.58 -34.01 73.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.806 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.451 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 45.6 mtt180 -90.22 -12.21 38.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.69 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.485 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -53.03 -46.33 97.7 Favored Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 83.4 Cg_exo -46.65 -24.92 3.17 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.806 2.337 . . . . 0.0 113.56 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.567 ' HB2' HG12 ' A' ' 50' ' ' ILE . 27.8 mt -67.23 -35.3 79.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.709 0.29 . . . . 0.0 111.189 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -45.01 95.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.519 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.408 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.3 t0 -75.2 -31.12 60.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.848 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.456 ' CB ' ' CD1' ' A' ' 9' ' ' PHE . . . -63.25 -54.69 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.093 -179.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -71.19 -38.1 69.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.544 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 2.0 tmm_? -36.94 -55.76 1.55 Allowed Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 81.5 Cg_exo -41.16 -34.23 1.55 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.766 2.31 . . . . 0.0 112.958 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.456 HD11 ' CE2' ' A' ' 9' ' ' PHE . 24.3 mt -65.31 -51.28 61.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.391 0.615 . . . . 0.0 110.338 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -44.78 134.75 4.84 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.186 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.17 165.55 1.33 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.636 2.224 . . . . 0.0 112.361 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.7 tp -55.8 -55.51 31.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.952 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.07 -53.61 56.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.034 0.445 . . . . 0.0 110.403 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.2 m170 -59.62 -31.02 69.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.324 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -45.64 92.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.3 179.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.6 t -61.53 -47.76 91.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.096 179.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.09 -29.19 69.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.199 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -60.87 -52.02 66.81 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.651 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -62.47 -43.22 99.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.602 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -59.59 -29.72 68.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.884 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.5 mt -85.65 -37.7 19.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.855 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.3 t -127.62 109.67 20.74 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.811 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.05 137.16 17.06 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.508 2.138 . . . . 0.0 112.575 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.0 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.466 -0.254 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 21.4 m -72.77 64.89 0.68 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 110.859 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mt -77.07 -51.11 11.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.865 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.458 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 11.7 tp -54.43 -52.85 60.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.827 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.44 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -57.75 -31.63 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.036 179.745 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.55 -41.02 93.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.145 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.405 ' CG2' ' CB ' ' A' ' 6' ' ' ALA . 25.8 t -70.47 -36.12 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.505 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.7 OUTLIER -62.57 -45.65 91.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.91 0.386 . . . . 0.0 110.214 179.45 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -33.82 71.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.752 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -58.54 -43.45 89.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.879 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.427 ' CE2' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.04 -49.69 27.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.764 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 19.2 mt -51.14 -38.32 51.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.721 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 7.0 mtm-85 -76.91 -36.95 56.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.431 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . 0.4 ' CD1' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -65.27 -14.83 61.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.319 178.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -93.07 -48.97 6.24 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.986 0.422 . . . . 0.0 110.855 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 5.8 mtmt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.865 -179.979 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 120.849 0.357 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.428 ' O ' ' CB ' ' A' ' 3' ' ' ARG . 16.8 p30 -164.2 148.78 9.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.819 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.428 ' CB ' ' O ' ' A' ' 2' ' ' ASP . 0.3 OUTLIER 82.41 -42.89 0.13 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.541 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -59.05 -45.15 91.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.833 0.349 . . . . 0.0 111.029 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -58.98 -40.77 81.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.53 -49.03 58.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.878 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -66.11 -26.76 67.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.111 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -71.06 -49.12 48.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.375 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.532 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -69.25 -44.39 72.04 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.083 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.45 85.16 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.0 t-160 -57.63 -42.43 83.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.561 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -59.98 -36.78 77.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.911 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.56 -49.73 81.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.219 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -57.68 -38.25 74.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -68.93 -39.14 79.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.469 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.3 mt -93.02 7.44 44.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.434 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 42.4 mm -148.11 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.621 0.724 . . . . 0.0 110.141 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.85 -35.65 69.09 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.951 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.97 174.36 1.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -107.49 -33.29 7.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.935 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -51.48 69.24 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.986 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -50.8 -34.82 29.14 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 4.8 mttm -71.8 -34.61 69.52 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.97 178.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.45 -44.47 96.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.169 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.94 -41.71 95.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.357 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.58 -42.76 93.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.495 ' CE1' ' CG ' ' B' ' 108' ' ' TYR . 15.8 m-85 -61.46 -44.44 97.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.521 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.42 -32.92 72.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.846 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.404 ' CG1' ' CD2' ' A' ' 42' ' ' LEU . 21.5 t -66.07 -51.83 55.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.905 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.431 ' CD2' ' CD1' ' A' ' 62' ' ' ILE . 32.2 mt -62.05 -36.2 80.91 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.47 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -62.35 -38.81 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.385 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 10.3 mmm -65.19 -48.04 74.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.54 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CG ' ' CD1' ' A' ' 42' ' ' LEU . 11.0 t80 -57.35 -33.67 68.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -70.1 -52.61 22.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.219 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -77.46 -54.96 5.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.918 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 p -66.87 -38.72 86.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.893 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.417 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.1 mmt 64.67 28.87 13.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.84 0.352 . . . . 0.0 110.716 -179.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.16 127.13 53.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.8 t -75.26 -7.55 10.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.168 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.9 -36.47 56.64 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.008 0.432 . . . . 0.0 110.199 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.82 -33.97 54.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.468 ' CD1' ' CG ' ' A' ' 33' ' ' TYR . 2.3 mt -67.27 -47.77 69.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.833 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.3 t -57.72 -45.65 86.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.555 -179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.84 -57.39 17.71 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.049 -179.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.88 -42.93 94.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.705 0.288 . . . . 0.0 111.28 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 50' ' ' ILE . 26.9 mt -50.42 -53.29 30.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.5 mttt -53.18 -48.36 68.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.873 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.9 mt -49.96 -42.95 49.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.083 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.9 p -101.09 5.72 10.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.427 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.536 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 41.6 mt -138.19 28.39 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.329 0.585 . . . . 0.0 110.941 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 12.6 m-20 -84.84 13.68 5.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.907 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -126.31 143.03 44.55 Favored Pre-proline 0 N--CA 1.457 -0.085 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.633 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -46.86 -38.92 23.93 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.281 1.987 . . . . 0.0 111.801 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.4 t -69.3 -32.82 72.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.582 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.439 ' CB ' ' HA ' ' A' ' 50' ' ' ILE . 91.5 mtt180 -90.12 -12.69 37.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.547 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.495 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.5 mt -54.42 -45.98 99.2 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.495 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 98.7 Cg_exo -44.2 -30.9 3.78 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.788 2.325 . . . . 0.0 113.69 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.492 ' HB2' HG12 ' A' ' 50' ' ' ILE . 16.7 mt -64.6 -39.86 94.47 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.686 0.279 . . . . 0.0 111.272 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.407 ' CD1' ' OH ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -54.5 -47.26 73.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.006 0.432 . . . . 0.0 110.627 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -75.31 -31.26 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.715 179.475 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.467 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -61.81 -57.02 13.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.907 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.431 ' CD1' ' CD2' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.52 -37.41 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.043 -179.177 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.442 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.3 mtp85 -36.44 -64.58 0.36 Allowed Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 73.7 Cg_exo -36.49 -33.85 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.234 2.623 . . . . 0.0 113.221 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.463 HD13 ' CE2' ' A' ' 9' ' ' PHE . 24.4 mt -65.13 -51.28 62.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.447 0.641 . . . . 0.0 110.117 179.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.432 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.8 OUTLIER -45.37 135.32 5.62 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.304 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.16 165.67 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.667 2.244 . . . . 0.0 112.336 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.4 mt -56.03 -57.06 13.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.117 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -46.58 88.63 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.706 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 23.2 m170 -65.37 -25.48 67.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.476 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.46 -55.03 35.71 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.569 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.403 HG11 ' N ' ' A' ' 73' ' ' GLU . 7.5 p -62.83 -37.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.385 179.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.403 ' N ' HG11 ' A' ' 72' ' ' VAL . 0.5 OUTLIER -70.2 -31.69 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.362 179.318 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.407 ' OH ' ' CD1' ' A' ' 59' ' ' PHE . 11.4 t80 -64.08 -47.82 78.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.477 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -62.95 -43.11 99.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.586 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -59.92 -33.5 71.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.683 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 28.4 mt -73.67 -35.45 65.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.901 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -106.99 103.47 47.83 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -80.95 -168.25 0.61 Allowed 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.744 2.296 . . . . 0.0 112.352 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.8 mmm-85 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.849 179.825 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 77.3 p -156.0 -45.89 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.999 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp -88.5 -35.24 17.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.88 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.414 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 21.9 tp -53.99 -52.59 60.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.797 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -31.7 67.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.704 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.32 -38.81 91.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.883 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . . . . . . . . . 22.1 t -69.66 -41.54 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.059 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.498 ' HA ' ' CE2' ' B' ' 108' ' ' TYR . 1.2 mt -57.61 -44.17 85.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.29 0.567 . . . . 0.0 109.909 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -73.66 -32.81 64.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.955 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . 0.476 ' O ' ' HG2' ' B' ' 110' ' ' ARG . 18.1 m-20 -57.3 -50.4 73.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.929 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.498 ' CE2' ' HA ' ' B' ' 105' ' ' LEU . 4.2 p90 -79.99 -33.92 38.98 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.244 -0.583 . . . . 0.0 109.997 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.461 ' HG ' ' CE1' ' B' ' 108' ' ' TYR . 12.6 mt -60.54 -36.64 78.92 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . 0.476 ' HG2' ' O ' ' B' ' 107' ' ' ASP . 0.2 OUTLIER -77.21 -36.27 54.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.275 179.381 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 9.0 mt -76.69 -6.27 51.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.402 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . 0.424 ' HE3' ' CD2' ' A' ' 27' ' ' TYR . 0.1 OUTLIER -74.73 -78.41 0.1 Allowed 'General case' 0 N--CA 1.458 -0.069 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.852 -179.939 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.224 -0.894 . . . . 0.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.852 0.358 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.83 72.43 10.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.942 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -178.42 -38.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.95 -42.79 99.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.813 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.21 -35.07 59.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.41 ' CB ' ' CG2' ' B' ' 104' ' ' VAL . . . -69.94 -51.05 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.004 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.28 -26.88 67.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.198 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.74 -45.97 60.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.456 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.552 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -70.7 -44.76 66.3 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.67 -42.77 89.25 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.15 -40.28 89.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.937 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -62.28 -36.27 81.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.06 179.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.403 ' O ' ' N ' ' A' ' 17' ' ' ILE . 47.2 t -59.41 -52.06 65.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.228 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -57.47 -35.22 69.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.167 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -69.01 -39.8 79.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.599 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 mt -98.12 11.17 38.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.557 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.406 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 36.0 mm -149.44 69.12 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-O 121.692 0.758 . . . . 0.0 110.143 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -60.42 -36.77 78.95 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.739 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -62.08 140.28 58.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.704 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.88 -36.61 56.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.36 65.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.852 0.358 . . . . 0.0 111.16 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -50.68 -34.75 27.85 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.417 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 9.9 mtpt -73.26 -35.34 66.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.847 178.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.09 -39.22 94.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.007 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.0 -43.41 78.94 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.311 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -62.87 -45.46 92.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.677 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.4 m-85 -60.93 -37.06 80.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.675 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.78 -32.99 73.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.592 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.0 -39.45 66.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.837 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.5 mt -69.89 -40.71 75.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.535 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -37.27 81.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.333 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.32 -46.03 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.13 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.442 ' CD1' HD22 ' A' ' 42' ' ' LEU . 6.4 t80 -60.15 -35.66 75.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.42 ' CE1' ' HE3' ' B' ' 102' ' ' LYS . 42.2 t-80 -74.58 -44.67 49.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.326 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -77.51 -54.98 5.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.162 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.3 p -74.17 -23.09 59.18 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 18.7 mmt 61.24 22.25 12.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.676 0.274 . . . . 0.0 110.798 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.47 116.45 30.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.707 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.415 ' HA ' ' CD2' ' A' ' 42' ' ' LEU . 21.6 t -80.15 -21.41 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.187 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.2 -32.46 56.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.7 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.2 t -73.4 -42.32 56.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.801 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.442 HD22 ' CD1' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -69.11 -36.15 77.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.701 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.411 ' N ' ' HG ' ' A' ' 42' ' ' LEU . 54.1 t -66.81 -43.16 89.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.023 0.44 . . . . 0.0 110.338 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.39 -56.05 27.23 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.334 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -60.99 -42.26 98.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.94 0.4 . . . . 0.0 110.719 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.419 HD13 ' CD1' ' A' ' 59' ' ' PHE . 12.2 mt -50.44 -43.74 55.18 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.743 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.3 mmtt -56.69 -50.59 71.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.245 0.545 . . . . 0.0 110.58 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -38.5 54.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.912 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 12.5 p -101.15 5.49 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.416 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.529 ' O ' ' CG2' ' A' ' 50' ' ' ILE . 69.2 mt -141.31 29.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.272 0.558 . . . . 0.0 110.826 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 47' ' ' LYS . 16.5 m-20 -82.11 9.06 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.413 ' CG ' ' CD ' ' A' ' 55' ' ' ARG . 2.8 pt-20 -132.61 153.93 81.31 Favored Pre-proline 0 N--CA 1.462 0.157 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.367 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.23 -38.25 61.05 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.836 2.357 . . . . 0.0 112.168 -179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -32.47 72.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.411 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.489 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 14.8 mtp180 -94.47 -10.24 32.96 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.441 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.584 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.4 mt -54.13 -54.2 50.14 Favored Pre-proline 0 C--N 1.332 -0.161 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.6 Cg_endo -41.44 -24.89 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.123 2.549 . . . . 0.0 113.841 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.502 ' HB2' HG12 ' A' ' 50' ' ' ILE . 17.6 mt -73.74 -31.49 63.38 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.312 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.419 ' CD1' HD13 ' A' ' 46' ' ' LEU . 0.1 OUTLIER -72.36 -41.29 66.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 110.963 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.444 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 3.3 m-20 -75.03 -30.92 61.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.654 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.537 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -68.81 -60.08 2.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.009 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -59.06 -35.84 59.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.929 -179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.436 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.2 ttt-85 -41.82 -65.64 0.49 Allowed Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.126 -179.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.471 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.1 Cg_exo -35.57 -30.75 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.337 2.691 . . . . 0.0 113.757 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.439 HD12 ' CZ ' ' A' ' 9' ' ' PHE . 25.0 mt -64.94 -50.78 65.07 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.468 0.652 . . . . 0.0 109.784 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.498 HG22 ' HB2' ' A' ' 70' ' ' HIS . 1.6 mp -41.59 127.94 2.37 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.452 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.417 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 52.9 Cg_exo -55.21 165.8 2.75 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.66 2.24 . . . . 0.0 112.175 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 mp -52.19 -50.18 62.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.287 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -57.74 -60.6 3.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.168 0.509 . . . . 0.0 110.39 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.498 ' HB2' HG22 ' A' ' 66' ' ' ILE . 44.7 m170 -58.76 -24.23 61.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.378 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -44.43 83.36 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.087 0.47 . . . . 0.0 109.82 179.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.6 t -61.58 -42.96 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.736 178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 -31.74 70.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.147 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -59.04 -48.62 80.94 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.546 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -68.0 -38.56 82.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.751 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -57.23 -35.34 69.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.804 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 mt -84.38 -31.2 24.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.771 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.4 t -137.1 113.12 9.61 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.754 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.41 166.24 26.22 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.46 2.107 . . . . 0.0 112.318 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.883 -179.955 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.542 -0.223 . . . . 0.0 112.542 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -107.9 83.87 1.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 110.965 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mt -107.99 -31.01 8.15 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.827 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.493 ' HG ' ' N ' ' B' ' 102' ' ' LYS . 2.1 pt? -52.24 -41.84 63.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.813 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.493 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 20.9 tttt -60.32 -38.84 84.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -34.41 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.722 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.413 HG21 HD13 ' A' ' 65' ' ' LEU . 2.8 t -70.97 -34.79 56.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.7 OUTLIER -66.67 -45.62 78.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.961 0.41 . . . . 0.0 110.065 179.195 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -69.87 -34.33 73.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.642 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.41 -48.25 81.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.4 ' CZ ' ' OH ' ' A' ' 27' ' ' TYR . 0.1 OUTLIER -68.23 -42.74 79.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.57 179.653 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 10.2 mt -51.18 -39.22 55.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.547 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 74.3 mtp180 -76.82 -34.96 57.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.09 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.0 -16.77 62.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.187 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -73.21 -73.94 0.19 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.816 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 4.9 mttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.895 179.96 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 mtt . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.779 0.324 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -177.01 57.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.74 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 53.0 mtm-85 -115.91 -34.44 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.157 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -59.3 -36.54 75.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.96 -39.78 78.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.212 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HA ' ' CD2' ' A' ' 9' ' ' PHE . . . -67.27 -51.18 56.09 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.085 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.3 ttp-105 -65.77 -26.79 67.88 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.303 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -72.6 -48.74 37.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.47 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.534 ' CD1' ' C ' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -68.86 -42.51 76.96 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.142 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.413 ' HD3' ' CG1' ' B' ' 104' ' ' VAL . 0.0 OUTLIER -61.26 -42.77 99.19 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.893 178.749 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -56.85 -41.44 77.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.176 0.512 . . . . 0.0 109.674 178.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -60.48 -38.05 83.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.018 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.402 ' O ' ' N ' ' A' ' 17' ' ' ILE . 57.5 t -57.68 -50.06 78.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.469 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -57.72 -37.81 74.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.105 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.593 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.6 mt -97.43 8.83 43.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.528 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.407 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 37.3 mm -148.96 69.13 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-O 121.619 0.723 . . . . 0.0 110.092 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -33.46 69.6 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.921 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.71 175.58 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.965 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -110.25 -29.76 8.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.959 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.53 -52.82 61.95 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -50.84 -34.88 29.69 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 11.2 mttt -72.95 -34.14 66.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.86 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -62.38 -42.65 99.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.041 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.93 -40.93 87.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.281 179.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 mt -61.46 -38.22 86.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.642 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.436 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 19.9 m-85 -65.48 -43.97 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.3 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.756 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 t -65.1 -50.18 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.905 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.9 mt -63.83 -33.5 75.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.426 179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -67.02 -41.6 86.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.66 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.416 ' O ' ' N ' ' A' ' 36' ' ' THR . 0.2 OUTLIER -64.83 -43.55 92.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.411 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.489 ' O ' ' HA ' ' A' ' 37' ' ' MET . 1.7 t80 -60.79 -38.41 85.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.841 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -74.88 -46.79 33.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.869 0.366 . . . . 0.0 111.323 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -54.74 6.0 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -95.2 -34.71 12.13 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.331 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.489 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.1 mtt 72.74 32.03 1.53 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.808 0.337 . . . . 0.0 110.793 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.37 115.1 22.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.412 ' O ' ' CG2' ' A' ' 43' ' ' VAL . 25.9 t -77.76 -23.71 14.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.8 -37.15 30.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.8 t -73.55 -35.86 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.664 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -73.96 -38.92 64.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.014 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.427 HG23 ' CD1' ' A' ' 74' ' ' TYR . 75.7 t -69.82 -43.04 80.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.936 0.398 . . . . 0.0 110.521 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.77 -50.01 72.29 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.404 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -62.95 -47.34 83.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.376 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' A' ' 50' ' ' ILE . 20.4 mt -50.8 -42.33 58.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 4.2 mtpt -58.48 -51.73 68.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.48 . . . . 0.0 110.811 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.7 mt -53.04 -35.54 59.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.941 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.7 p -100.97 3.21 10.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.36 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.603 HG12 ' HB2' ' A' ' 58' ' ' LEU . 54.7 mt -139.09 27.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.131 0.491 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -85.54 16.09 4.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.812 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -127.58 140.97 39.51 Favored Pre-proline 0 CA--C 1.523 -0.059 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.59 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -45.33 -38.88 15.78 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.378 2.052 . . . . 0.0 111.881 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 t -69.32 -34.76 75.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.716 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.586 ' HB3' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -89.72 -13.88 35.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.775 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.633 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 12.8 mt -49.0 -51.62 54.09 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.633 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 5.1 Cg_exo -39.97 -28.33 0.25 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.242 2.628 . . . . 0.0 113.893 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.603 ' HB2' HG12 ' A' ' 50' ' ' ILE . 9.3 mt -63.48 -38.58 91.7 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.644 0.259 . . . . 0.0 111.102 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.481 ' CE1' ' CZ ' ' A' ' 74' ' ' TYR . 0.2 OUTLIER -59.82 -44.0 94.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 0.0 110.674 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -75.1 -31.58 61.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.692 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.452 ' HB3' ' CD1' ' A' ' 9' ' ' PHE . . . -62.82 -60.25 3.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.391 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.406 ' CG1' HD11 ' A' ' 65' ' ' LEU . 0.2 OUTLIER -66.93 -30.01 48.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.829 -179.645 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.468 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 16.1 ttp180 -40.21 -58.08 2.52 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.2 Cg_endo -48.48 -30.0 14.92 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.706 2.271 . . . . 0.0 113.125 -178.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.446 HD12 ' CZ ' ' A' ' 9' ' ' PHE . 12.9 mt -65.37 -49.61 68.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.482 0.658 . . . . 0.0 109.872 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.454 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.7 OUTLIER -47.12 133.73 9.08 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.159 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.33 165.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.488 2.125 . . . . 0.0 112.14 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.6 tp -56.46 -57.79 10.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.871 0.367 . . . . 0.0 110.928 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.7 pttt -58.97 -48.93 79.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.081 0.467 . . . . 0.0 110.429 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.3 m170 -60.73 -29.21 69.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.386 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.66 -42.3 91.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.059 0.457 . . . . 0.0 110.241 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 31.1 t -62.45 -45.35 98.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.362 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.33 -31.88 69.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.458 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.481 ' CZ ' ' CE1' ' A' ' 59' ' ' PHE . 63.2 t80 -70.75 -41.0 72.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.731 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -37.68 83.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.74 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -66.47 -41.22 89.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.664 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 16.8 mt -68.18 -34.87 77.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.071 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.409 ' HB ' ' CE1' ' A' ' 59' ' ' PHE . 5.1 t -93.07 125.49 54.66 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.972 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.08 -170.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.396 2.064 . . . . 0.0 112.294 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.022 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.541 -0.224 . . . . 0.0 112.541 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 13.5 m -101.95 105.95 16.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.825 0.345 . . . . 0.0 110.891 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 30.9 mt -83.76 -26.07 29.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.974 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.527 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.6 OUTLIER -51.76 -53.2 42.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.855 -179.842 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 pttt -61.2 -31.7 71.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.72 -40.39 94.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.945 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' VAL . . . . . 0.445 HG21 ' CD1' ' A' ' 65' ' ' LEU . 2.4 t -71.16 -46.5 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.458 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -65.08 -45.5 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.957 0.408 . . . . 0.0 110.478 179.845 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' GLU . . . . . 0.432 ' HA ' ' CD2' ' B' ' 109' ' ' LEU . 5.0 tt0 -66.03 -37.83 86.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.075 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -64.57 -36.37 84.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.34 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.417 ' CE1' ' OH ' ' A' ' 27' ' ' TYR . 6.3 t80 -76.29 -55.96 5.08 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.377 -179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.432 ' CD2' ' HA ' ' B' ' 106' ' ' GLU . 2.7 pp -51.28 -34.97 35.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.488 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 17.2 mtt-85 -76.92 -36.43 56.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.917 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 10.9 mt -68.32 -12.44 61.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.429 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -70.64 -73.45 0.17 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.943 0.402 . . . . 0.0 110.876 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.881 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tpp85 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.863 0.363 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.03 -33.73 73.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.854 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.7 t -64.24 -35.58 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.076 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.71 -51.0 38.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.995 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.412 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.31 -26.84 68.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.229 179.313 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -70.76 -47.69 58.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.475 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.728 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.58 -44.53 67.18 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -43.87 77.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.736 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.412 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 9.6 m170 -60.13 -41.14 92.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.085 0.469 . . . . 0.0 109.952 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -61.22 -37.55 83.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.129 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.861 HG22 ' CD2' ' A' ' 58' ' ' LEU . 47.0 t -59.97 -49.13 85.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.392 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.66 -37.54 73.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.178 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -68.84 -37.12 78.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.699 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 mt -97.72 8.96 43.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.535 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.646 ' O ' HG22 ' A' ' 17' ' ' ILE . 36.7 mm -149.76 69.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-O 121.731 0.777 . . . . 0.0 110.112 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.803 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.83 160.72 16.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.724 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.73 -29.42 14.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.969 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.98 -53.64 54.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.517 ' HB2' HG23 ' A' ' 17' ' ' ILE . 11.0 mt-10 -50.91 -34.84 30.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.412 ' O ' ' CG ' ' A' ' 27' ' ' TYR . 8.2 mttm -73.52 -34.78 65.4 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.905 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -65.42 -43.8 89.36 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.15 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.897 ' O ' HG23 ' A' ' 29' ' ' VAL . 5.7 t80 -64.37 -41.3 96.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.205 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.37 -39.85 95.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.359 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.412 ' CG ' ' O ' ' A' ' 23' ' ' LYS . 20.6 m-85 -60.29 -43.8 95.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.495 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -64.66 -34.43 78.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.498 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 25' ' ' TYR . 17.5 t -67.82 -43.41 86.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.783 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.037 HD21 HD11 ' A' ' 62' ' ' ILE . 16.1 mt -66.12 -42.51 89.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.628 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -32.93 74.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.624 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.415 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 70.9 mmm -66.66 -47.06 73.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.583 ' CG ' HD12 ' A' ' 42' ' ' LEU . 13.3 t80 -59.37 -40.83 87.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.038 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -67.86 -43.39 79.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.346 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.507 ' HG3' HG23 ' A' ' 36' ' ' THR . 19.4 pt20 -77.24 -50.0 13.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.901 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.507 HG23 ' HG3' ' A' ' 35' ' ' GLN . 22.3 p -78.08 -30.5 49.64 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.425 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.2 mmt 62.64 28.73 16.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.952 0.406 . . . . 0.0 110.718 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -119.53 122.31 41.35 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.88 ' O ' HG23 ' A' ' 43' ' ' VAL . 14.9 t -78.66 -7.27 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.537 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.0 -36.99 58.96 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.091 0.472 . . . . 0.0 110.22 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.95 -34.03 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.959 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.819 HD23 HG12 ' A' ' 29' ' ' VAL . 1.3 mt -65.52 -46.34 80.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.844 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 39' ' ' VAL . 33.4 t -57.54 -45.73 86.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.423 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.91 -58.0 15.91 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.772 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -64.67 -36.35 83.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.089 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.587 HD13 ' OH ' ' A' ' 74' ' ' TYR . 13.8 mt -52.89 -55.02 26.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.831 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -54.48 -43.35 71.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.767 179.685 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.98 -45.78 61.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.788 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 49' ' ' VAL . 13.4 p -100.98 8.42 8.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.342 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.766 HG22 ' O ' ' A' ' 50' ' ' ILE . 60.1 mt -138.51 27.11 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.33 0.586 . . . . 0.0 111.034 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.46 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -85.78 15.91 4.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.803 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -127.65 144.27 50.53 Favored Pre-proline 0 C--O 1.23 0.072 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.427 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.514 ' HA ' HD12 ' A' ' 56' ' ' LEU . 6.5 Cg_endo -48.7 -37.97 36.06 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.347 2.032 . . . . 0.0 111.513 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -69.38 -34.07 74.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.644 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.763 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -90.46 -12.45 37.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.79 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 53' ' ' PRO . 13.8 mt -52.51 -45.86 95.5 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.9 Cg_exo -47.01 -23.92 2.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.735 2.29 . . . . 0.0 113.595 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.861 ' CD2' HG22 ' A' ' 13' ' ' VAL . 12.4 mt -73.73 -37.63 65.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.736 0.303 . . . . 0.0 111.322 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.664 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -60.06 -48.83 80.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.908 0.385 . . . . 0.0 111.111 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.402 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -75.22 -30.99 60.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.994 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.728 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -63.73 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.283 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 1.037 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -59.93 -34.24 55.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -41.53 -63.12 0.89 Allowed Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.905 -178.98 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 87.0 Cg_exo -33.8 -33.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.338 2.692 . . . . 0.0 113.541 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.476 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.5 mt -64.91 -53.81 40.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.355 0.598 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.574 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -43.41 132.19 3.59 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.116 179.52 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.86 165.5 10.02 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.618 2.212 . . . . 0.0 112.019 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.442 ' O ' HG23 ' A' ' 72' ' ' VAL . 2.1 tt -51.99 -51.36 57.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.219 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -61.06 2.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 0.0 110.539 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.607 ' HB3' HG21 ' A' ' 39' ' ' VAL . 36.8 m170 -59.21 -23.66 62.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -43.43 86.94 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.116 0.484 . . . . 0.0 110.166 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 68' ' ' LEU . 27.2 t -64.85 -45.51 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.374 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -32.98 70.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.473 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.805 ' HB2' HG11 ' A' ' 39' ' ' VAL . 7.5 t80 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.539 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 10.6 mt . . . . . 0 C--O 1.232 0.175 0 CA-C-O 121.027 0.442 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.62 HD11 HD23 ' A' ' 30' ' ' LEU . 9.5 tp -55.32 -52.66 62.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.597 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.42 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.5 OUTLIER -56.75 -33.41 66.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.05 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.076 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.9 t -68.69 -36.53 74.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.257 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.471 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.8 OUTLIER -63.5 -45.62 89.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 110.294 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.7 -35.8 81.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.623 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.8 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.908 0.385 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.45 -33.55 73.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.825 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.0 t -61.42 -36.86 75.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.207 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.99 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.04 -51.16 41.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.105 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 -67.17 -26.84 66.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.156 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -72.7 -45.99 55.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.289 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.691 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.76 -43.92 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -44.92 84.82 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.768 178.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -58.91 -39.31 81.13 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.202 0.525 . . . . 0.0 109.743 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -62.47 -38.1 88.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.282 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.69 HG22 HD22 ' A' ' 58' ' ' LEU . 52.9 t -59.6 -48.21 88.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.512 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -57.59 -42.64 83.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.17 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -69.01 -33.56 73.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.617 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.43 ' O ' HD13 ' A' ' 17' ' ' ILE . 69.5 mt -95.4 6.44 49.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.651 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.645 ' O ' HG22 ' A' ' 17' ' ' ILE . 40.3 mm -147.12 68.35 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-O 121.657 0.741 . . . . 0.0 110.037 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.15 -35.75 67.51 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.921 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -63.46 174.89 1.14 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -109.3 -30.51 7.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.41 -51.88 66.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.487 ' OE1' HG23 ' A' ' 17' ' ' ILE . 12.6 mt-10 -50.88 -34.8 29.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.39 0.614 . . . . 0.0 109.42 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -72.4 -33.67 67.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.26 -43.08 95.97 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.147 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.87 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.3 t80 -64.56 -43.22 94.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.233 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.4 tp -59.09 -41.13 87.33 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.54 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -60.0 -47.92 83.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.76 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -59.09 -39.32 81.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.735 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 25' ' ' TYR . 5.1 t -63.87 -49.65 80.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.929 HD21 HD11 ' A' ' 62' ' ' ILE . 5.4 mt -62.17 -40.71 96.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.365 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -60.27 -34.53 73.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.398 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.63 ' SD ' HG11 ' A' ' 41' ' ' VAL . 4.2 mmt -66.08 -51.41 58.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.242 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.49 ' CG ' HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -53.53 -35.53 60.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.085 0.469 . . . . 0.0 110.543 179.419 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -55.64 5.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.84 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.69 -55.24 5.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.425 ' HG1' ' C ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -82.74 -36.17 25.99 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.603 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.461 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.3 mmt 64.77 23.93 12.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.02 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.596 ' OD2' HG23 ' A' ' 41' ' ' VAL . 29.4 t70 -100.59 114.74 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.333 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.895 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.5 t -73.01 -8.62 11.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.583 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.51 ' HB3' ' OD2' ' A' ' 38' ' ' ASP . . . -75.57 -34.26 60.67 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.072 0.463 . . . . 0.0 110.243 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.63 HG11 ' SD ' ' A' ' 32' ' ' MET . 29.0 t -73.62 -33.85 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.417 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.818 HD23 HG12 ' A' ' 29' ' ' VAL . 0.5 OUTLIER -69.18 -42.63 75.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.831 179.901 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 39' ' ' VAL . 46.7 t -58.06 -43.29 84.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.091 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.84 -56.17 15.95 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.78 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.463 ' CB ' HG22 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -63.08 -49.12 75.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.839 0.352 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HG ' HG11 ' A' ' 29' ' ' VAL . 68.5 mt -50.57 -48.0 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.086 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.77 -49.57 72.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.075 0.464 . . . . 0.0 110.634 179.776 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.429 HD13 ' OH ' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -51.85 -39.65 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.023 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 49' ' ' VAL . 12.4 p -101.46 7.28 9.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.445 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.798 HG23 ' O ' ' A' ' 55' ' ' ARG . 77.9 mt -143.15 28.06 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.257 0.551 . . . . 0.0 111.419 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.447 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.4 p30 -89.81 14.99 10.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.641 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -130.94 150.47 76.68 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.575 0.226 . . . . 0.0 110.607 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.504 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.5 Cg_endo -52.1 -38.6 70.78 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.402 2.068 . . . . 0.0 111.447 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.32 -33.23 72.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.367 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.798 ' O ' HG23 ' A' ' 50' ' ' ILE . 11.1 mtt85 -91.75 -5.88 52.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.573 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.6 mt -60.56 -44.8 96.58 Favored Pre-proline 0 CA--C 1.53 0.206 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.68 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 90.4 Cg_exo -43.48 -28.11 1.57 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.705 2.27 . . . . 0.0 113.421 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.69 HD22 HG22 ' A' ' 13' ' ' VAL . 16.0 mt -73.85 -33.91 64.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.902 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.591 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -61.28 -48.65 80.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.734 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.409 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.1 t0 -75.22 -31.0 60.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.651 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.691 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.71 -62.89 1.53 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.738 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.929 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.81 -31.78 53.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.724 -179.585 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.505 ' HA ' HD12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -37.15 -66.69 0.27 Allowed Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 112.327 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 76.8 Cg_exo -36.6 -32.39 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.092 2.528 . . . . 0.0 113.561 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.583 HD12 ' CG1' ' A' ' 62' ' ' ILE . 19.2 mt -65.67 -51.09 62.16 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.718 0.771 . . . . 0.0 109.439 179.32 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.505 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.9 mt -44.26 121.87 4.08 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.373 -1.285 . . . . 0.0 111.53 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.4 ' O ' ' N ' ' A' ' 71' ' ' GLN . 76.1 Cg_exo -47.84 165.75 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.832 2.355 . . . . 0.0 112.439 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.3 tt -55.51 -56.9 14.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.785 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -44.47 97.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.43 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 23.5 m170 -63.9 -29.3 70.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.288 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.418 ' HA ' HG21 ' A' ' 66' ' ' ILE . 1.4 mt-30 -61.51 -42.08 98.27 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.172 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.89 -46.26 89.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.09 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -65.01 -33.07 75.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.213 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.3 t80 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.512 179.641 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.419 ' O ' HG23 ' B' ' 104' ' ' VAL . 3.9 mt . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.787 0.327 . . . . 0.0 110.852 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 13.2 tp -54.45 -52.8 60.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.854 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 45.5 tttm -57.45 -31.52 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.835 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.98 -36.79 80.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.877 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.99 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.4 t -71.04 -37.19 66.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.475 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.8 OUTLIER -65.0 -45.57 85.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.006 0.431 . . . . 0.0 110.291 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -68.92 -34.63 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 179.716 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.827 0.346 . . . . 0.0 110.991 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.07 -40.3 89.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.947 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.7 t -60.45 -35.02 60.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.003 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.049 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.27 -50.95 42.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.182 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -26.77 67.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -71.22 -48.98 48.11 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.688 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -70.04 -43.02 72.13 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.919 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -44.11 81.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.716 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.49 -42.68 88.13 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.2 -35.43 75.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.29 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.68 HG13 HD22 ' A' ' 58' ' ' LEU . 43.3 t -62.22 -49.03 85.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.616 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.63 -37.74 73.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.198 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -68.95 -30.11 68.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.456 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.404 ' O ' HD13 ' A' ' 17' ' ' ILE . 5.2 mt -105.35 10.18 33.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.611 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.74 HG23 ' HB2' ' A' ' 22' ' ' GLU . 37.3 mm -146.26 67.96 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 CA-C-O 121.679 0.752 . . . . 0.0 110.151 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -79.12 -26.18 42.9 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.023 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.2 OUTLIER -49.2 -25.14 2.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.551 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 19' ' ' ASN . 5.8 t0 82.76 -53.14 0.19 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.097 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.57 -50.06 68.89 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.74 ' HB2' HG23 ' A' ' 17' ' ' ILE . 21.9 mt-10 -50.86 -34.59 28.67 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -35.7 76.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.953 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.423 ' HA ' ' CD2' ' A' ' 27' ' ' TYR . 1.0 OUTLIER -62.23 -47.37 84.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.014 0.435 . . . . 0.0 110.187 179.467 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.906 ' O ' HG23 ' A' ' 29' ' ' VAL . 3.6 t80 -61.41 -39.33 90.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.328 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.636 HD22 HG11 ' A' ' 13' ' ' VAL . 0.2 OUTLIER -60.3 -40.99 92.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.497 179.583 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.423 ' CD2' ' HA ' ' A' ' 24' ' ' ASP . 11.6 m-85 -60.87 -46.82 89.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.408 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.43 -37.03 82.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.766 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 1.062 HG12 HD13 ' A' ' 42' ' ' LEU . 21.8 t -63.29 -44.64 99.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.807 HD21 HD11 ' A' ' 62' ' ' ILE . 7.0 mt -64.77 -46.41 82.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.509 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -32.33 72.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.46 ' HG2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -68.23 -45.72 72.48 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.454 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.652 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.3 t80 -59.47 -38.37 80.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.963 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -74.52 -44.9 49.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.826 0.346 . . . . 0.0 111.544 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -55.09 5.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 112.059 -179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 p -74.71 -40.24 61.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.434 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.2 mtp 69.96 26.04 4.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.89 0.376 . . . . 0.0 110.7 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.46 124.66 53.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.645 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.889 ' O ' HG23 ' A' ' 43' ' ' VAL . 29.6 t -77.33 -10.36 13.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.207 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.72 -35.41 44.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.964 0.411 . . . . 0.0 110.61 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.46 HG11 ' HG2' ' A' ' 32' ' ' MET . 32.8 t -71.11 -34.3 54.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.236 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.062 HD13 HG12 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -70.0 -47.99 59.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.002 179.78 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 39' ' ' VAL . 46.9 t -57.44 -40.41 74.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.788 0.328 . . . . 0.0 111.039 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.93 -56.25 17.42 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.698 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.503 ' HB3' HG22 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.43 -48.61 77.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.838 0.351 . . . . 0.0 111.13 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.56 -46.93 57.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.147 -179.707 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.3 -52.33 64.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.792 179.81 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.92 -38.6 36.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.958 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.626 HG21 HD12 ' A' ' 26' ' ' LEU . 14.7 p -101.2 4.6 10.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.594 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.901 HG23 ' O ' ' A' ' 55' ' ' ARG . 58.2 mt -138.46 27.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 121.267 0.555 . . . . 0.0 111.161 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.435 ' N ' ' O ' ' A' ' 47' ' ' LYS . 34.3 m-20 -85.49 12.81 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.748 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.75 142.82 43.23 Favored Pre-proline 0 C--N 1.334 -0.071 0 O-C-N 122.3 -0.25 . . . . 0.0 110.674 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.441 ' HA ' HD12 ' A' ' 56' ' ' LEU . 88.5 Cg_exo -46.27 -38.87 20.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.288 1.992 . . . . 0.0 111.788 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -33.62 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.588 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.901 ' O ' HG23 ' A' ' 50' ' ' ILE . 40.8 mtt180 -90.75 -11.43 39.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.727 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.497 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -54.31 -45.35 99.28 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 88.0 Cg_exo -45.87 -24.76 2.28 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.853 2.369 . . . . 0.0 113.667 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.68 HD22 HG13 ' A' ' 13' ' ' VAL . 9.3 mt -72.92 -35.83 67.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.698 0.285 . . . . 0.0 110.919 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.402 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -58.01 -50.79 72.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.751 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.422 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 2.8 t0 -75.38 -31.26 60.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.809 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.469 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.9 -56.25 23.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.849 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.807 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -67.17 -32.54 58.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 111.559 -179.548 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.439 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.5 mtp180 -37.37 -63.72 0.47 Allowed Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.473 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.439 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 74.9 Cg_exo -36.9 -32.64 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.127 2.552 . . . . 0.0 113.617 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.532 HD11 ' CE2' ' A' ' 9' ' ' PHE . 14.1 mt -65.53 -50.75 64.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.624 0.726 . . . . 0.0 109.79 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.465 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -46.62 133.07 8.14 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.242 179.754 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -49.6 165.6 0.26 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.64 2.226 . . . . 0.0 112.284 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -57.87 10.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.855 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -50.02 75.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.039 0.447 . . . . 0.0 110.303 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.441 ' CB ' HG23 ' A' ' 66' ' ' ILE . 53.0 m170 -60.7 -27.59 68.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.374 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -65.35 -44.21 88.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.9 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 19.9 t -61.45 -43.54 96.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.326 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -66.51 -47.06 74.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.383 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.7 t80 . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.443 179.547 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.424 ' HB3' HD22 ' A' ' 65' ' ' LEU . 49.6 mt . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.759 0.314 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.505 HD23 ' H ' ' B' ' 101' ' ' LEU . 0.4 OUTLIER -54.03 -35.18 61.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.128 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.535 ' HA ' HD21 ' B' ' 105' ' ' LEU . 0.0 OUTLIER -68.6 -33.19 73.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.95 -38.23 76.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.049 HG22 ' HB1' ' A' ' 6' ' ' ALA . 39.0 t -71.01 -51.0 38.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.371 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.566 HD12 ' N ' ' B' ' 106' ' ' GLU . 3.8 pp -61.57 -33.48 73.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.573 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 106' ' ' GLU . . . . . 0.566 ' N ' HD12 ' B' ' 105' ' ' LEU . 6.6 tt0 -73.79 -38.77 64.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 0.0 110.257 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.591 179.501 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.756 0.312 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.95 -33.68 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.829 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.43 -35.92 74.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.018 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -70.22 -50.89 35.27 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.964 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -26.81 68.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.155 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -70.97 -48.98 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.357 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.77 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.04 -43.59 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.084 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.745 ' HD2' HG12 ' B' ' 104' ' ' VAL . 2.5 tpm_? -57.1 -44.94 83.7 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.712 178.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.83 -40.04 79.1 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.792 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.7 mtpt -62.82 -36.8 84.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.029 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.902 HG22 HD22 ' A' ' 58' ' ' LEU . 46.5 t -58.59 -48.99 84.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.285 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -57.58 -42.25 82.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.081 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -69.1 -34.62 75.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.523 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.433 ' O ' HD13 ' A' ' 17' ' ' ILE . 78.3 mt -95.12 7.34 46.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.595 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.64 ' O ' HG22 ' A' ' 17' ' ' ILE . 40.0 mm -148.27 68.69 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.73 0.776 . . . . 0.0 110.129 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -57.16 -36.13 70.38 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.97 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -64.55 169.18 5.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.695 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -102.54 -31.46 10.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.95 67.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.933 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.623 ' O ' HD12 ' A' ' 26' ' ' LEU . 22.5 mt-10 -50.77 -34.69 28.29 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 27.7 mttt -72.71 -35.19 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.939 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -62.86 -41.11 99.24 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.132 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.804 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -65.92 -45.75 80.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.298 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.623 HD12 ' O ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -60.36 -39.56 87.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.703 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.0 m-85 -61.82 -44.06 97.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.701 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -65.56 -40.98 93.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.648 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.804 HG23 ' O ' ' A' ' 25' ' ' TYR . 46.4 t -60.82 -53.25 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.063 0.459 . . . . 0.0 110.982 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.007 HD21 HD11 ' A' ' 62' ' ' ILE . 4.0 mt -59.98 -36.19 76.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.657 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -43.14 84.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.569 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -45.06 94.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.046 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.675 ' CE1' HG22 ' A' ' 39' ' ' VAL . 6.6 t80 -57.65 -48.17 80.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.781 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.576 ' CE1' ' HB2' ' B' ' 102' ' ' LYS . 5.2 t60 -74.99 -33.66 61.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.873 0.368 . . . . 0.0 111.664 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -77.44 -54.98 5.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.7 p -93.98 -6.0 46.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.475 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.5 mmt 58.87 23.5 11.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.708 0.29 . . . . 0.0 110.96 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.419 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.5 t0 -98.22 116.72 31.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.915 0.388 . . . . 0.0 110.912 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.845 ' O ' HG23 ' A' ' 43' ' ' VAL . 27.8 t -82.52 -20.7 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.27 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.64 -28.1 55.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.804 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 38' ' ' ASP . 48.0 t -73.46 -43.77 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.782 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.5 pp -68.53 -39.21 81.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.753 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.845 HG23 ' O ' ' A' ' 39' ' ' VAL . 84.9 t -60.65 -40.71 85.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.853 0.358 . . . . 0.0 110.389 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.51 -59.13 9.23 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.26 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.474 ' CB ' HG22 ' A' ' 29' ' ' VAL . 12.4 m-20 -60.1 -44.2 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 110.771 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.773 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.7 mt -51.3 -44.13 61.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.73 -48.31 78.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.105 0.479 . . . . 0.0 110.627 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 mt -54.17 -37.53 64.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.824 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 49' ' ' VAL . 11.9 p -101.04 5.13 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.428 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.879 HG23 ' O ' ' A' ' 55' ' ' ARG . 65.7 mt -142.33 29.08 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-O 121.301 0.572 . . . . 0.0 110.72 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.7 p-10 -88.07 15.2 7.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.945 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.2 pt-20 -131.69 149.12 72.54 Favored Pre-proline 0 C--N 1.334 -0.098 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.765 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.603 ' HA ' HD12 ' A' ' 56' ' ' LEU . 7.2 Cg_endo -49.51 -38.51 44.47 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.697 2.265 . . . . 0.0 111.812 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.2 t -69.12 -33.93 74.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.609 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.879 ' O ' HG23 ' A' ' 50' ' ' ILE . 97.9 mtt180 -94.5 -5.28 46.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.685 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.603 HD12 ' HA ' ' A' ' 53' ' ' PRO . 12.2 mt -59.44 -45.24 98.91 Favored Pre-proline 0 CA--C 1.532 0.284 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 81.4 Cg_exo -42.94 -29.03 1.38 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.772 2.315 . . . . 0.0 113.475 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.902 HD22 HG22 ' A' ' 13' ' ' VAL . 14.4 mt -73.94 -32.29 63.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.741 0.305 . . . . 0.0 111.023 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.469 ' CD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -60.83 -50.02 75.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.095 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.407 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 22.5 t0 -75.21 -31.02 60.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.894 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.739 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.73 -60.26 4.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.95 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 1.007 HD11 HD21 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -59.3 -36.99 66.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.928 -179.534 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.475 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -36.32 -66.8 0.25 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.479 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.478 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 79.7 Cg_exo -36.14 -33.04 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.191 2.594 . . . . 0.0 113.342 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.657 HD11 ' CE2' ' A' ' 9' ' ' PHE . 22.7 mt -65.07 -51.93 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.0 109.875 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.427 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -47.22 136.73 8.74 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.032 179.622 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.25 165.61 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.483 2.122 . . . . 0.0 112.34 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 tp -57.09 -57.87 10.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.955 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -51.41 69.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.106 0.479 . . . . 0.0 110.345 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.427 ' CB ' HG23 ' A' ' 66' ' ' ILE . 31.5 m170 -59.91 -28.31 67.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.325 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.32 -44.31 95.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.086 0.469 . . . . 0.0 110.155 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.32 -47.35 93.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.345 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.45 -39.38 93.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.356 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.735 ' CE2' HG22 ' A' ' 43' ' ' VAL . 57.6 t80 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.691 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.656 ' O ' HG23 ' B' ' 104' ' ' VAL . 6.0 mt . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.824 0.345 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.812 HD11 HD23 ' A' ' 30' ' ' LEU . 13.9 tp -55.1 -52.86 61.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.093 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.576 ' HB2' ' CE1' ' A' ' 34' ' ' HIS . 0.6 OUTLIER -55.6 -37.57 68.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.92 -36.54 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.719 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.018 HG22 ' HB1' ' A' ' 6' ' ' ALA . 2.1 t -71.09 -34.09 53.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.078 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -70.87 -45.72 63.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.973 0.416 . . . . 0.0 110.365 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.0 -39.74 87.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.903 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.753 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.784 0.326 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -65.58 -36.81 84.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.753 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.2 -35.13 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.912 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.006 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.63 -51.15 53.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.271 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.427 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -64.41 -26.95 68.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.245 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.8 -49.08 50.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.553 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -68.83 -43.29 75.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HG3' ' CG1' ' B' ' 104' ' ' VAL . 0.7 OUTLIER -61.96 -40.23 94.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.881 178.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.427 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 8.2 m170 -56.99 -41.37 78.28 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -60.96 -36.11 78.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.795 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.627 HG13 HD22 ' A' ' 58' ' ' LEU . 50.1 t -58.82 -48.7 85.38 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.105 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.17 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.7 -39.22 76.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.119 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -68.78 -31.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.465 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.3 mt -102.29 8.94 40.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.44 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.699 ' O ' HG22 ' A' ' 17' ' ' ILE . 31.3 mm -149.97 69.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 CA-C-O 121.677 0.751 . . . . 0.0 110.025 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -58.96 -33.84 71.11 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.899 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -63.46 160.8 15.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.801 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -97.64 -30.76 12.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.978 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.15 -52.95 61.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.007 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -50.95 -34.78 30.22 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.2 mttt -72.82 -34.3 66.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.766 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -61.77 -43.03 99.65 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -65.55 -45.54 83.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.289 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.7 tt -60.81 -40.81 94.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.455 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -59.26 -43.42 92.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -69.54 -37.34 77.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.813 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 25' ' ' TYR . 40.7 t -62.36 -52.33 61.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.876 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.017 HD21 HD11 ' A' ' 62' ' ' ILE . 41.2 mt -60.9 -41.12 95.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.667 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -40.22 87.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.268 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -45.62 87.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.971 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.561 ' CG ' HD22 ' A' ' 42' ' ' LEU . 4.9 t80 -55.58 -44.67 77.1 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.941 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -74.87 -34.42 62.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.556 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.47 -55.06 5.7 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.0 p -88.07 -14.62 38.43 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.447 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.8 mmt 61.37 23.6 13.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.739 0.304 . . . . 0.0 110.626 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -98.48 116.72 31.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.744 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.762 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.4 t -81.27 -20.77 10.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.281 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.09 -29.27 48.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.339 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.2 t -73.42 -42.88 56.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.79 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.749 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.1 pp -70.2 -39.73 75.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.744 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.762 HG23 ' O ' ' A' ' 39' ' ' VAL . 81.6 t -65.01 -37.36 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.938 0.399 . . . . 0.0 110.388 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.34 -56.68 18.59 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.137 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -64.72 -44.69 89.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.857 0.36 . . . . 0.0 110.774 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.874 ' HG ' HG11 ' A' ' 29' ' ' VAL . 13.7 mt -50.97 -41.07 59.15 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.688 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.48 -46.62 89.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.398 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.68 -34.49 65.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.563 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 49' ' ' VAL . 9.4 p -100.92 0.3 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.3 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.902 HG23 ' O ' ' A' ' 55' ' ' ARG . 50.8 mt -138.5 29.31 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.334 0.587 . . . . 0.0 110.939 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.483 ' N ' ' O ' ' A' ' 47' ' ' LYS . 20.7 p30 -87.53 16.77 5.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.787 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.7 mm-40 -127.35 143.57 47.7 Favored Pre-proline 0 C--N 1.334 -0.091 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.443 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.427 ' HA ' HD12 ' A' ' 56' ' ' LEU . 5.6 Cg_endo -47.83 -38.47 30.37 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.452 2.101 . . . . 0.0 111.518 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.33 -33.8 73.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.713 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.902 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.8 mtt180 -92.04 -10.32 39.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.885 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.493 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.9 mt -55.62 -44.7 99.79 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.733 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.3 Cg_exo -44.31 -26.77 1.73 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.661 2.24 . . . . 0.0 113.474 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.699 HD12 HG12 ' A' ' 50' ' ' ILE . 3.7 mt -73.69 -32.0 63.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.842 0.353 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.504 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -67.54 -40.78 85.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.81 179.864 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 18.2 t70 -75.37 -31.0 60.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.811 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.63 -56.84 6.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.864 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 1.017 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -61.27 -38.16 79.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.86 -179.239 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.444 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -39.69 -65.14 0.45 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.258 -179.002 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 70.6 Cg_exo -35.59 -32.91 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.261 2.641 . . . . 0.0 113.483 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.6 mt -65.07 -53.72 41.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 109.822 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.557 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.5 mp -42.26 128.15 2.8 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.306 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.79 165.69 1.09 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.791 2.328 . . . . 0.0 112.347 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -52.47 -53.6 43.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.031 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.539 ' O ' HG12 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -57.51 -54.65 44.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.682 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.557 ' CB ' HG23 ' A' ' 66' ' ' ILE . 27.2 m170 -63.11 -20.44 65.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.555 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -53.91 32.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.967 0.413 . . . . 0.0 110.244 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 69' ' ' LYS . 6.1 p -61.91 -37.17 77.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.161 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.68 -38.12 73.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.065 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.6 t80 . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.468 179.416 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.45 ' HB3' HD22 ' A' ' 65' ' ' LEU . 6.9 mt . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.74 0.305 . . . . 0.0 111.158 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.47 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -54.21 -40.55 67.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.993 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.553 ' HA ' HD21 ' B' ' 105' ' ' LEU . 0.6 OUTLIER -66.84 -31.99 72.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.86 -34.9 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.053 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.006 HG22 ' HB1' ' A' ' 6' ' ' ALA . 25.2 t -70.85 -55.19 14.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.342 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.587 HD12 ' N ' ' B' ' 106' ' ' GLU . 2.8 pp -58.6 -40.98 84.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.803 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 106' ' ' GLU . . . . . 0.587 ' N ' HD12 ' B' ' 105' ' ' LEU . 10.5 tt0 -73.7 -33.42 64.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.804 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.039 -179.992 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 120.678 0.275 . . . . 0.0 111.652 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.6 tttp -58.69 -33.4 70.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.9 0.381 . . . . 0.0 110.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 51.6 t -59.89 -38.66 77.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.804 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.71 -51.04 54.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.27 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.437 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -67.04 -26.88 66.97 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.108 179.392 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -72.64 -48.84 36.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.388 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.924 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -68.44 -42.86 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.47 ' CD ' HG12 ' B' ' 104' ' ' VAL . 2.1 tpt180 -58.26 -46.12 86.57 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.095 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.7 t-160 -56.54 -42.05 77.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -60.75 -35.92 77.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.292 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.673 HG22 HD22 ' A' ' 58' ' ' LEU . 60.5 t -60.67 -49.84 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.601 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -57.75 -39.34 77.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.501 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -69.12 -30.12 68.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.735 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.452 HD13 ' HG2' ' A' ' 57' ' ' PRO . 82.4 mt -96.43 -0.22 49.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.621 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.991 HD11 HD11 ' A' ' 58' ' ' LEU . 91.4 mt -143.95 69.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 CA-C-O 122.122 0.963 . . . . 0.0 110.374 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -76.07 -2.81 32.63 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.88 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -71.66 -23.54 61.69 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 t0 78.55 -55.83 0.47 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.19 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -51.91 57.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.857 0.36 . . . . 0.0 111.245 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.49 ' HB2' HG23 ' A' ' 17' ' ' ILE . 22.6 mt-10 -50.88 -34.75 29.52 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -71.02 -34.46 71.32 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.89 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -45.09 96.06 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.114 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.886 ' O ' HG23 ' A' ' 29' ' ' VAL . 10.6 t80 -64.57 -41.39 96.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.149 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.608 HD23 HG11 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -60.69 -36.57 79.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.533 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -64.6 -47.38 78.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.612 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.4 -37.22 86.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.594 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 25' ' ' TYR . 40.8 t -69.34 -36.39 71.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.608 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.974 HD21 HD11 ' A' ' 62' ' ' ILE . 14.0 mt -68.53 -43.95 75.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.54 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -36.75 84.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.382 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.76 ' CE ' HG21 ' A' ' 36' ' ' THR . 0.0 OUTLIER -63.97 -48.23 77.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.202 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.715 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.1 t80 -55.51 -43.06 75.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.992 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -74.78 -38.45 62.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.782 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -55.08 5.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.76 HG21 ' CE ' ' A' ' 32' ' ' MET . 63.2 p -82.9 -13.81 55.38 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.432 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 20.5 mmt 60.45 21.18 10.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.768 0.318 . . . . 0.0 110.929 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.8 OUTLIER -94.52 113.11 24.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.857 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.8 t -82.12 -23.32 9.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.225 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.82 -28.8 58.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.986 0.422 . . . . 0.0 110.915 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.611 HG23 ' HB3' ' A' ' 38' ' ' ASP . 53.8 t -73.42 -43.93 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.841 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.715 HD22 ' CG ' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -69.23 -37.04 77.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.678 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 39' ' ' VAL . 71.7 t -62.09 -46.38 96.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.955 0.407 . . . . 0.0 110.144 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -58.42 -56.63 24.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.995 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.602 ' HA ' HD12 ' A' ' 48' ' ' LEU . 64.7 m-20 -60.6 -36.94 79.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 110.447 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.851 HD22 ' CD1' ' A' ' 50' ' ' ILE . 10.4 mt -52.45 -46.21 66.35 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.523 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.8 mptt -55.42 -46.38 76.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.543 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.602 HD12 ' HA ' ' A' ' 45' ' ' ASP . 5.1 mt -54.41 -39.47 67.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.641 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.608 HG11 HD23 ' A' ' 26' ' ' LEU . 14.4 p -101.13 8.61 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.272 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.851 ' CD1' HD22 ' A' ' 46' ' ' LEU . 88.3 mt -144.79 28.68 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 121.305 0.574 . . . . 0.0 110.666 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' ' O ' ' A' ' 47' ' ' LYS . 21.9 p-10 -86.21 10.35 14.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.219 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -133.4 155.97 80.21 Favored Pre-proline 0 C--N 1.334 -0.084 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.249 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.559 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.4 Cg_endo -52.29 -38.84 73.21 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.824 2.349 . . . . 0.0 112.086 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.75 -34.18 75.15 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.461 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.844 ' O ' HG23 ' A' ' 50' ' ' ILE . 87.1 mtt180 -94.49 -1.21 53.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.743 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 53' ' ' PRO . 11.9 mt -64.73 -47.41 75.45 Favored Pre-proline 0 CA--C 1.53 0.203 0 CA-C-O 120.605 0.24 . . . . 0.0 111.644 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.52 -26.81 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.732 2.288 . . . . 0.0 113.605 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.991 HD11 HD11 ' A' ' 17' ' ' ILE . 20.8 mt -69.71 -34.84 74.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.725 0.298 . . . . 0.0 111.242 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.501 ' CD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -56.52 -48.38 77.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.01 0.433 . . . . 0.0 110.887 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.474 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.0 p-10 -75.28 -31.01 60.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.867 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.924 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.69 -56.96 14.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.996 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.974 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -67.49 -37.64 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.458 -178.905 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.608 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 11.6 ttm-85 -37.37 -59.88 0.96 Allowed Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 90.8 Cg_exo -38.24 -37.14 0.6 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.86 2.373 . . . . 0.0 113.094 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.667 HD13 HD12 ' B' ' 101' ' ' LEU . 12.3 mt -65.2 -54.11 34.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.369 0.604 . . . . 0.0 110.047 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.53 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -44.31 129.02 4.67 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.148 179.552 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.404 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 78.4 Cg_exo -50.62 165.27 0.43 Allowed 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.63 2.22 . . . . 0.0 112.424 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.786 ' O ' HG23 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -56.16 -49.21 74.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.296 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -46.62 81.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.137 0.494 . . . . 0.0 110.418 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.561 ' CG ' HG21 ' A' ' 39' ' ' VAL . 29.2 m170 -64.95 -30.2 71.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.85 -32.28 69.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 0.0 110.298 179.547 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 68' ' ' LEU . 29.4 t -67.9 -46.2 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.061 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -69.18 -38.49 78.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.227 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.515 ' CD2' HG22 ' A' ' 43' ' ' VAL . 11.3 t80 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.335 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.451 ' O ' HG23 ' B' ' 104' ' ' VAL . 65.6 mt . . . . . 0 N--CA 1.463 0.181 0 CA-C-O 120.553 0.216 . . . . 0.0 111.466 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.667 HD12 HD13 ' A' ' 65' ' ' LEU . 8.6 tp -51.63 -52.64 46.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.827 0.346 . . . . 0.0 110.984 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -31.5 65.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.674 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -69.86 -32.58 71.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.804 HG22 ' HB1' ' A' ' 6' ' ' ALA . 1.6 t -71.04 -43.27 76.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.668 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.523 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.7 OUTLIER -65.67 -45.59 82.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.258 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.52 -33.64 73.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.63 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--N 1.33 -0.269 0 CA-C-O 121.024 0.44 . . . . 0.0 110.899 179.837 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 . . . . . 0 N--CA 1.465 0.323 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -59.02 -33.38 70.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.754 0.311 . . . . 0.0 110.763 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -56.95 -38.61 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.012 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.976 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.33 -50.93 58.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.071 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.415 ' HD2' ' HB3' ' B' ' 107' ' ' ASP . 0.0 OUTLIER -63.75 -26.92 68.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.238 179.432 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -49.15 51.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.626 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.669 ' HE2' HG21 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.18 -43.19 74.72 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.802 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -45.2 82.7 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.907 178.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 14.6 t-160 -57.69 -41.82 82.42 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.117 0.484 . . . . 0.0 109.852 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -60.14 -35.98 76.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.001 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.66 HG13 ' CD2' ' A' ' 58' ' ' LEU . 48.0 t -61.21 -47.7 92.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.32 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -57.6 -39.03 75.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.149 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -69.0 -34.66 75.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.429 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 17' ' ' ILE . 69.5 mt -95.88 6.28 49.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.508 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.609 ' O ' HG22 ' A' ' 17' ' ' ILE . 39.2 mm -148.08 69.03 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-O 121.708 0.766 . . . . 0.0 110.081 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.56 -33.51 66.21 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.016 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.82 164.26 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.771 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -98.82 -32.7 11.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.942 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.93 63.16 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.953 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' HG23 ' A' ' 17' ' ' ILE . 27.0 mt-10 -50.87 -34.69 29.16 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.064 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 19.3 mttt -73.29 -34.77 65.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.947 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.73 -40.57 97.07 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.14 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.897 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -67.17 -43.65 81.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 179.381 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.468 HD22 HG11 ' A' ' 13' ' ' VAL . 28.2 tp -61.5 -38.11 86.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.647 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 20.5 m-85 -63.22 -46.3 87.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.664 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -38.07 88.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.626 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 25' ' ' TYR . 34.8 t -62.24 -47.09 94.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.878 HD21 HD11 ' A' ' 62' ' ' ILE . 17.0 mt -64.39 -44.79 90.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.496 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -65.4 -35.09 79.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.415 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.404 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -68.34 -44.71 74.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.442 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.976 ' CD2' HD13 ' B' ' 101' ' ' LEU . 8.9 t80 -61.08 -36.07 78.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.115 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -74.43 -41.0 61.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.581 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.597 ' HG3' HG23 ' A' ' 36' ' ' THR . 15.7 pt20 -77.43 -52.51 9.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.987 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.597 HG23 ' HG3' ' A' ' 35' ' ' GLN . 17.7 p -79.38 -21.93 45.04 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.8 mmt 60.66 22.39 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.672 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.456 ' HB3' HG23 ' A' ' 41' ' ' VAL . 8.2 m-20 -104.13 119.77 39.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.776 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.76 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.9 t -79.14 -18.29 13.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.237 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.16 -29.63 48.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.456 HG23 ' HB3' ' A' ' 38' ' ' ASP . 46.6 t -73.47 -44.41 54.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.662 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.759 HD12 HD12 ' A' ' 46' ' ' LEU . 1.2 pp -68.98 -38.31 79.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.767 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 39' ' ' VAL . 70.8 t -66.82 -37.32 79.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.917 0.389 . . . . 0.0 110.422 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.4 -57.96 14.47 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.68 -0.772 . . . . 0.0 111.894 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.69 -41.7 99.25 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.945 0.403 . . . . 0.0 110.634 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.839 ' HG ' HG11 ' A' ' 29' ' ' VAL . 11.2 mt -52.19 -40.17 61.15 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.622 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -59.92 -46.61 88.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.386 179.468 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 mt -55.53 -36.72 67.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.485 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.631 HG13 HG13 ' A' ' 50' ' ' ILE . 14.6 p -101.13 4.53 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.394 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.916 HG23 ' O ' ' A' ' 55' ' ' ARG . 73.9 mt -142.52 29.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.26 0.552 . . . . 0.0 110.997 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.486 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.3 p30 -87.51 16.72 5.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.917 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.409 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 5.0 mm-40 -129.54 142.54 45.63 Favored Pre-proline 0 C--N 1.333 -0.11 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.65 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.538 ' HA ' HD12 ' A' ' 56' ' ' LEU . 85.7 Cg_exo -45.69 -39.01 17.83 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.205 1.936 . . . . 0.0 111.835 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 t -69.25 -35.14 75.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.698 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.916 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -89.96 -10.5 44.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.74 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.1 mt -53.08 -46.11 97.86 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 95.6 Cg_exo -44.17 -26.57 1.56 Allowed 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.727 2.285 . . . . 0.0 113.67 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.66 ' CD2' HG13 ' A' ' 13' ' ' VAL . 26.5 mt -73.67 -30.25 62.79 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.064 -0.254 . . . . 0.0 111.114 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.532 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -69.72 -44.35 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.987 0.422 . . . . 0.0 110.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.31 -31.42 60.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.848 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.523 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.66 -57.32 10.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.656 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.878 HD11 HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -65.83 -31.46 53.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.514 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.466 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 2.7 ttp180 -40.04 -59.58 1.75 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.5 Cg_endo -48.81 -26.1 9.27 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.801 2.334 . . . . 0.0 113.348 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.616 HD11 ' CE2' ' A' ' 9' ' ' PHE . 21.0 mt -65.01 -54.54 28.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.35 0.595 . . . . 0.0 109.694 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.582 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.1 mp -42.07 136.03 2.26 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.425 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.46 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 54.2 Cg_exo -52.24 165.79 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.807 2.338 . . . . 0.0 112.46 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.3 -55.96 25.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.16 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -50.24 74.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.419 . . . . 0.0 110.435 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.582 ' CB ' HG23 ' A' ' 66' ' ' ILE . 26.8 m170 -61.73 -28.24 69.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.178 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.77 -43.72 98.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.92 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.3 t -62.31 -45.22 99.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.96 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.04 -30.75 71.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.744 ' HE2' HD11 ' A' ' 42' ' ' LEU . 4.5 t80 . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.672 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.433 ' HB3' HD22 ' A' ' 65' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.893 0.378 . . . . 0.0 110.927 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.976 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.3 OUTLIER -56.46 -36.75 69.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.928 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.558 ' HA ' HD21 ' B' ' 105' ' ' LEU . 3.8 tttt -68.54 -32.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.819 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.96 -37.31 75.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.082 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.976 HG22 ' HB1' ' A' ' 6' ' ' ALA . 33.2 t -69.58 -54.54 19.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.518 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.57 HD12 ' N ' ' B' ' 106' ' ' GLU . 2.4 pp -57.34 -39.8 76.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.677 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 106' ' ' GLU . . . . . 0.57 ' N ' HD12 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -73.01 -34.86 66.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.342 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 107' ' ' ASP . . . . . 0.415 ' HB3' ' HD2' ' A' ' 7' ' ' ARG . 1.6 m-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.622 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.784 0.326 . . . . 0.0 110.883 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -59.61 -39.22 83.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.4 t -61.13 -35.06 63.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.882 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.968 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.02 -51.18 41.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.236 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.466 ' HA ' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -67.64 -26.87 66.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.25 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -73.18 -46.06 52.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.953 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.92 -44.74 65.56 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -63.89 -35.99 82.48 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 179.259 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.465 ' N ' ' HG3' ' A' ' 10' ' ' ARG . 1.2 t60 -62.32 -42.66 99.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -61.1 -35.91 78.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.82 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.89 HG22 HD23 ' A' ' 58' ' ' LEU . 64.0 t -62.84 -44.85 99.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.306 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.48 -42.21 82.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.958 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -69.15 -37.17 78.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.267 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.3 mt -89.9 6.06 43.61 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.417 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.662 ' O ' HG22 ' A' ' 17' ' ' ILE . 37.4 mm -145.91 67.98 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 CA-C-O 121.743 0.782 . . . . 0.0 110.208 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.41 -31.26 67.55 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.917 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -73.32 122.27 21.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -62.88 -27.55 69.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.106 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.34 -52.02 63.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.899 0.38 . . . . 0.0 111.079 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.544 ' HB2' HG23 ' A' ' 17' ' ' ILE . 28.5 mt-10 -50.8 -34.59 28.14 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -71.72 -34.7 69.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.815 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.63 97.55 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.13 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.876 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -65.4 -44.71 86.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.333 179.326 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.44 -41.75 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.539 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -59.62 -43.25 93.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.523 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.65 -35.99 82.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.459 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.946 HG12 HD23 ' A' ' 42' ' ' LEU . 24.4 t -65.6 -44.98 93.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.849 HD21 HD11 ' A' ' 62' ' ' ILE . 19.2 mt -63.85 -44.4 93.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.489 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.6 mtp180 -59.73 -34.06 72.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.475 ' HG2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -65.21 -52.12 56.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.495 179.5 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' A' ' 37' ' ' MET . 6.3 t80 -55.98 -34.36 65.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.123 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -74.84 -43.95 51.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.805 0.336 . . . . 0.0 111.109 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.74 -54.91 5.8 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 p -84.42 -33.08 23.79 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.546 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.2 mmt 63.77 39.28 8.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.987 0.422 . . . . 0.0 110.665 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -113.71 125.21 53.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.73 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.858 ' O ' HG23 ' A' ' 43' ' ' VAL . 17.2 t -75.76 -14.0 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.988 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.71 -38.94 37.8 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.996 0.427 . . . . 0.0 110.215 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.475 HG11 ' HG2' ' A' ' 32' ' ' MET . 37.8 t -69.41 -34.04 60.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.88 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.961 HD22 HD11 ' A' ' 46' ' ' LEU . 1.7 mt -66.55 -50.71 62.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.549 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.858 HG23 ' O ' ' A' ' 39' ' ' VAL . 32.1 t -61.61 -38.13 79.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.29 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.61 -56.65 23.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.821 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.586 ' HB3' HG22 ' A' ' 29' ' ' VAL . 69.7 m-20 -72.95 -41.32 64.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.74 0.305 . . . . 0.0 111.341 -179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.961 HD11 HD22 ' A' ' 42' ' ' LEU . 30.5 mt -50.33 -45.19 54.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.949 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -61.78 -46.72 88.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.699 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.481 HD13 ' OH ' ' A' ' 25' ' ' TYR . 1.6 mt -50.83 -37.69 44.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.064 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.524 HG13 HG13 ' A' ' 50' ' ' ILE . 11.2 p -101.04 -6.55 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.491 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.884 HG23 ' O ' ' A' ' 55' ' ' ARG . 7.4 mt -129.3 31.0 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.105 0.479 . . . . 0.0 111.303 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.474 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.3 p30 -86.68 16.2 4.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.743 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -127.33 141.21 40.14 Favored Pre-proline 0 C--N 1.334 -0.1 0 C-N-CA 120.986 -0.285 . . . . 0.0 110.659 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.435 ' HA ' HD12 ' A' ' 56' ' ' LEU . 88.8 Cg_exo -46.15 -38.49 19.58 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.267 1.978 . . . . 0.0 111.678 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.5 p -69.36 -34.77 75.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.492 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.884 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -88.4 -13.91 39.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.589 -179.72 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.653 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 17.1 mt -50.34 -50.71 69.37 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 4.3 Cg_exo -40.06 -28.83 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.291 2.661 . . . . 0.0 113.754 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.89 HD23 HG22 ' A' ' 13' ' ' VAL . 7.5 mt -65.69 -32.04 73.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.767 0.318 . . . . 0.0 111.002 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.591 ' HD1' HG21 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -60.88 -40.65 93.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.319 179.52 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.408 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -75.13 -31.36 61.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.481 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.953 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -65.12 -57.91 7.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.198 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.881 HG13 HD12 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -65.35 -35.58 75.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.749 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.466 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 7.8 ttp180 -38.55 -58.25 1.65 Allowed Pre-proline 0 N--CA 1.468 0.44 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 9.5 Cg_endo -51.92 -28.42 31.52 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.597 2.198 . . . . 0.0 112.869 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.881 HD12 HG13 ' A' ' 62' ' ' ILE . 20.4 mt -65.2 -44.5 88.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.673 0.749 . . . . 0.0 109.371 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.581 HD11 HD13 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -62.54 130.08 93.18 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.643 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -51.86 165.46 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.566 2.177 . . . . 0.0 112.218 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -55.55 30.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.075 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmtt -57.36 -54.2 49.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.034 0.445 . . . . 0.0 110.417 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 14.8 m170 -59.6 -28.32 67.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.454 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -61.72 -44.07 97.62 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 30.7 t -65.2 -45.06 94.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.275 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.11 -27.04 67.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.444 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.596 ' CD1' HG22 ' A' ' 43' ' ' VAL . 56.7 t80 . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.517 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' A' ' 65' ' ' LEU . 7.9 mt . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.845 0.355 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.486 ' HA ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -53.5 -52.57 59.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 179.941 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.428 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -55.42 -32.74 62.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -39.27 85.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.968 HG22 ' HB1' ' A' ' 6' ' ' ALA . 21.7 t -71.03 -31.46 45.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.285 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.658 HD21 HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -68.53 -45.67 71.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.905 0.383 . . . . 0.0 110.3 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -69.4 -34.01 73.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.564 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.638 179.753 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.807 0.337 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -39.08 81.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.056 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.92 -40.66 63.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.213 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.57 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -66.07 -50.85 62.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.406 ' O ' ' CG ' ' A' ' 11' ' ' HIS . 9.3 mtp180 -65.09 -26.72 68.34 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.01 -49.11 48.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.754 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.884 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.71 -41.61 71.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.071 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.17 92.53 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.818 178.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.406 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 0.3 OUTLIER -59.29 -41.16 88.3 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 179.028 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -61.49 -34.52 75.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.171 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.806 HG13 ' CD2' ' A' ' 58' ' ' LEU . 47.8 t -62.13 -48.58 87.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -57.51 -40.18 78.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.175 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -69.06 -32.91 72.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.388 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -98.54 8.29 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.466 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.738 HG23 ' HB2' ' A' ' 22' ' ' GLU . 35.2 mm -147.68 68.56 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-O 121.721 0.772 . . . . 0.0 110.287 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -81.33 -8.82 59.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.274 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -66.93 -13.28 61.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.539 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.8 -61.61 0.49 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.609 0.242 . . . . 0.0 110.921 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.66 -48.73 66.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.916 0.388 . . . . 0.0 110.834 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.738 ' HB2' HG23 ' A' ' 17' ' ' ILE . 40.9 mt-10 -50.99 -34.45 29.13 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.78 -35.97 75.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.074 179.006 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.43 -44.61 86.8 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.998 0.428 . . . . 0.0 110.397 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 29' ' ' VAL . 13.4 t80 -60.84 -44.17 97.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.587 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.535 HD11 HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -59.29 -40.84 87.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.734 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -61.93 -41.43 97.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.768 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.36 -36.19 82.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.581 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.834 HG11 ' HG ' ' A' ' 46' ' ' LEU . 41.1 t -69.76 -36.63 70.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.835 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.78 HD21 HD11 ' A' ' 62' ' ' ILE . 11.4 mt -70.24 -43.59 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.652 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.5 ttt85 -66.81 -35.45 80.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.485 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 23.7 tpp -69.14 -43.76 73.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.397 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.659 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.3 t80 -62.13 -39.64 93.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.905 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.552 ' CE1' ' HG3' ' B' ' 102' ' ' LYS . 56.1 t60 -74.86 -41.38 59.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.399 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -54.99 5.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.855 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 p -76.53 -23.14 53.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.84 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.437 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.5 mmt 63.64 18.38 11.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.771 0.319 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.618 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.0 OUTLIER -97.87 116.6 30.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.757 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.794 ' O ' HG23 ' A' ' 43' ' ' VAL . 19.5 t -79.41 -21.41 12.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.203 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.33 -30.81 54.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.877 0.37 . . . . 0.0 110.697 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.618 HG23 ' HB3' ' A' ' 38' ' ' ASP . 40.8 t -73.55 -41.88 55.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.677 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.685 HD12 HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -69.75 -38.09 76.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.696 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 39' ' ' VAL . 76.4 t -65.87 -37.21 79.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 CA-C-O 120.961 0.41 . . . . 0.0 110.212 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.04 -57.98 13.65 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.962 179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -60.92 -44.37 97.28 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.021 0.438 . . . . 0.0 110.472 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.834 ' HG ' HG11 ' A' ' 29' ' ' VAL . 10.7 mt -51.02 -40.73 58.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.3 OUTLIER -59.34 -50.24 74.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.271 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mp -51.45 -37.25 47.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.811 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.609 HG13 HG13 ' A' ' 50' ' ' ILE . 14.9 p -101.0 3.7 10.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.435 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.855 HG23 ' O ' ' A' ' 55' ' ' ARG . 71.3 mt -140.4 29.64 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' A' ' 47' ' ' LYS . 2.3 m120 -84.32 11.19 8.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.871 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.417 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 20.1 mm-40 -127.3 148.76 67.53 Favored Pre-proline 0 C--O 1.231 0.103 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.807 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.451 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.69 -37.8 65.0 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.45 2.1 . . . . 0.0 111.445 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.29 -32.49 71.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.296 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.855 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.9 mtp180 -91.31 -9.22 45.81 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.391 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.5 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 18.1 mt -57.01 -44.55 99.83 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.718 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.17 -27.34 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.689 2.26 . . . . 0.0 113.577 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.806 ' CD2' HG13 ' A' ' 13' ' ' VAL . 15.8 mt -70.51 -30.27 66.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.692 0.282 . . . . 0.0 111.037 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.486 ' HE1' ' HH ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.378 . . . . 0.0 110.637 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.419 ' O ' ' HD2' ' A' ' 64' ' ' PRO . 3.0 m-20 -75.48 -31.27 60.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.805 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.884 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -65.57 -64.49 0.85 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.453 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.78 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.7 -28.32 44.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.447 ' HG2' ' CE2' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -41.72 -63.96 0.75 Allowed Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -178.857 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.43 ' HG2' ' O ' ' A' ' 61' ' ' ALA . 2.4 Cg_endo -46.25 -26.98 4.26 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.963 2.442 . . . . 0.0 113.214 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.572 HD12 ' CG1' ' A' ' 62' ' ' ILE . 16.1 mt -65.41 -51.86 57.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 109.542 179.365 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.445 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.0 OUTLIER -47.68 129.89 11.05 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.7 -1.137 . . . . 0.0 111.156 179.458 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.443 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 53.7 Cg_exo -52.86 165.8 1.08 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.693 2.262 . . . . 0.0 112.418 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.9 mt -54.94 -56.85 15.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.135 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -54.6 44.58 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.249 0.547 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.445 ' CB ' HG23 ' A' ' 66' ' ' ILE . 20.1 m170 -57.54 -29.35 64.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.219 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.74 -44.26 96.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.846 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -59.29 -46.68 92.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.824 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.47 -31.13 71.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.99 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.651 ' HE1' HD11 ' A' ' 42' ' ' LEU . 2.3 t80 . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.354 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' B' ' 100' ' ' LEU . 17.5 mt . . . . . 0 N--CA 1.463 0.2 0 CA-C-O 120.663 0.268 . . . . 0.0 111.718 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.609 HD22 ' CE2' ' A' ' 33' ' ' TYR . 1.8 pp -51.59 -40.58 60.09 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.764 0.316 . . . . 0.0 110.871 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.552 ' HG3' ' CE1' ' A' ' 34' ' ' HIS . 0.7 OUTLIER -61.64 -33.84 74.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.329 179.269 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.04 -32.43 70.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.569 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.705 HG11 ' CZ ' ' A' ' 9' ' ' PHE . 2.0 t -68.78 -39.92 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.48 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.57 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.5 OUTLIER -65.12 -45.64 84.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.334 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -33.83 73.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.616 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.735 179.818 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.816 0.341 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.52 71.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.3 t -57.78 -38.34 64.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.26 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.788 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -68.1 -50.94 51.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.15 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -26.7 67.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.174 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.19 -48.27 52.55 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.461 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.738 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -70.77 -43.2 69.27 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -58.05 -42.18 84.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.696 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.04 -44.65 94.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.436 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HD2' ' HA ' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -61.58 -32.56 72.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.215 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 9' ' ' PHE . 49.0 t -62.32 -49.37 84.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.123 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -57.65 -37.94 74.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.851 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.92 -41.81 77.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.336 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.5 ' O ' HD13 ' A' ' 17' ' ' ILE . 3.4 mt -87.42 4.89 41.42 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.357 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.654 ' O ' HG22 ' A' ' 17' ' ' ILE . 41.6 mm -143.0 67.07 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-O 121.785 0.802 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -54.41 -31.25 54.7 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.975 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -73.13 164.64 26.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.619 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.32 -28.68 13.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.991 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.54 -51.64 67.74 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.533 ' HB2' HG23 ' A' ' 17' ' ' ILE . 27.4 mt-10 -50.9 -34.77 29.79 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 17.9 mttt -71.53 -34.9 70.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.966 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.97 -42.87 99.18 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -67.87 -40.5 83.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 179.451 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.504 HD22 HG11 ' A' ' 13' ' ' VAL . 0.1 OUTLIER -61.22 -46.03 92.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.63 179.675 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 15.4 m-30 -60.51 -42.65 96.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.729 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.73 -37.68 88.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.709 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 25' ' ' TYR . 46.6 t -63.62 -51.82 65.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.894 HD21 HD11 ' A' ' 62' ' ' ILE . 6.2 mt -60.56 -37.87 82.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.606 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.2 mmt-85 -65.23 -41.24 94.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.383 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.9 mmt -64.09 -46.83 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.462 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.692 ' CE1' HG22 ' A' ' 39' ' ' VAL . 13.0 t80 -59.59 -37.79 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.043 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -74.71 -44.76 48.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.563 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -55.15 5.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.151 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -75.21 -20.78 59.09 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.413 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 1.3 mmt 61.11 20.15 10.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.68 0.276 . . . . 0.0 110.7 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.485 ' HB3' HG23 ' A' ' 41' ' ' VAL . 3.9 t0 -104.73 120.68 41.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.91 0.386 . . . . 0.0 110.864 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.831 ' O ' HG23 ' A' ' 43' ' ' VAL . 44.5 t -79.67 -16.61 13.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.21 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.51 -28.45 56.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.879 0.371 . . . . 0.0 110.947 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.485 HG23 ' HB3' ' A' ' 38' ' ' ASP . 53.2 t -73.18 -45.25 54.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.751 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.736 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.4 pp -67.92 -38.6 83.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.751 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 39' ' ' VAL . 71.2 t -61.03 -38.99 80.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.003 0.43 . . . . 0.0 110.372 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.71 -59.19 8.47 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.157 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.466 ' CB ' HG22 ' A' ' 29' ' ' VAL . 76.6 m-20 -60.53 -45.03 95.33 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.781 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.811 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.9 mt -50.81 -44.48 59.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.2 tppt? -57.91 -46.61 84.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.567 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.09 -37.64 64.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.736 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.5 p -100.97 2.87 10.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.468 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.874 HG23 ' O ' ' A' ' 55' ' ' ARG . 53.2 mt -139.13 29.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.406 0.622 . . . . 0.0 110.955 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.478 ' N ' ' O ' ' A' ' 47' ' ' LYS . 28.6 p30 -86.28 17.65 3.59 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.873 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.431 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 24.2 mm-40 -126.03 141.22 38.94 Favored Pre-proline 0 N--CA 1.458 -0.05 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.439 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.464 ' HA ' HD12 ' A' ' 56' ' ' LEU . 85.4 Cg_exo -45.42 -38.9 16.24 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.157 1.905 . . . . 0.0 111.884 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.2 t -69.4 -36.03 76.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.851 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.874 ' O ' HG23 ' A' ' 50' ' ' ILE . 61.0 mtt85 -87.82 -15.73 36.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.768 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.653 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 15.8 mt -46.54 -51.92 33.35 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.0 Cg_exo -39.13 -29.17 0.18 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.358 2.706 . . . . 0.0 113.739 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.591 HD21 HG13 ' A' ' 13' ' ' VAL . 1.0 OUTLIER -60.61 -30.14 69.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.821 0.344 . . . . 0.0 111.041 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.634 ' HD1' HG21 ' A' ' 50' ' ' ILE . 2.0 m-85 -69.61 -40.32 76.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 7.1 m-20 -75.28 -31.07 60.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.937 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.604 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.93 -61.85 1.63 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.047 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.894 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -58.34 -36.17 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.968 -179.27 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 17.9 ttp180 -41.35 -66.68 0.37 Allowed Pre-proline 0 CA--C 1.538 0.487 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.11 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 88.9 Cg_exo -34.55 -33.62 0.08 OUTLIER 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.309 2.673 . . . . 0.0 113.497 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.481 HD11 ' CE2' ' A' ' 9' ' ' PHE . 6.8 mt -64.77 -53.59 44.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 110.141 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.622 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.6 OUTLIER -38.74 128.89 1.15 Allowed Pre-proline 0 CA--C 1.537 0.463 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.647 179.595 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.405 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 50.8 Cg_exo -54.08 165.7 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.687 2.258 . . . . 0.0 112.251 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.9 mt -52.21 -51.28 59.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.264 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.628 ' O ' HG12 ' A' ' 72' ' ' VAL . 7.7 mmtm -57.89 -60.11 4.22 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.218 0.532 . . . . 0.0 110.387 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.622 ' HB2' HG23 ' A' ' 66' ' ' ILE . 18.5 m170 -60.12 -19.87 55.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.618 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.21 -53.55 29.19 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.628 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.4 p -61.65 -35.26 66.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.248 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -70.92 -42.99 69.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.088 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.232 179.346 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.0 mt . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.881 0.372 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.618 HD13 HD21 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -51.76 -53.03 44.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -60.48 -31.81 70.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.777 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.56 -40.04 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.76 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.788 HG22 ' HB1' ' A' ' 6' ' ' ALA . 9.4 t -71.06 -40.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.856 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.618 HD21 HD13 ' B' ' 101' ' ' LEU . 1.1 mt -63.33 -45.7 90.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.035 0.445 . . . . 0.0 109.981 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -60.39 -38.69 84.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.466 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.572 179.701 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.895 0.379 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -65.0 -35.41 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.2 t -61.75 -35.05 65.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.202 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.055 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -68.69 -50.97 46.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.209 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 2.8 ttp180 -63.9 -26.84 68.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.422 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.73 -49.32 48.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.66 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.93 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.6 -43.36 72.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -44.76 81.57 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.933 178.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.4 t-160 -58.24 -42.75 87.03 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 109.817 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -59.62 -32.96 70.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.199 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.594 HG13 ' CD2' ' A' ' 58' ' ' LEU . 44.9 t -64.57 -47.58 88.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.58 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -57.6 -41.07 80.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.382 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.97 -31.42 70.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.742 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -101.4 8.96 41.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.611 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.664 ' O ' HG22 ' A' ' 17' ' ' ILE . 37.4 mm -149.06 69.04 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-O 121.701 0.763 . . . . 0.0 110.148 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.81 -36.13 76.11 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.789 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -63.79 150.17 45.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.672 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -86.89 -30.18 21.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.091 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.61 -52.63 63.57 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.004 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.544 ' CD ' HD12 ' A' ' 17' ' ' ILE . 17.2 mt-10 -50.88 -34.7 29.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 82.2 mttt -72.74 -34.27 66.92 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.89 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.1 -45.5 88.38 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.153 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.924 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.8 OUTLIER -62.49 -42.81 99.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.158 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.69 HD12 HG11 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -58.18 -40.99 82.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.441 179.405 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 13.4 m-30 -61.01 -43.03 99.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.293 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -68.61 -36.69 79.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.608 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 25' ' ' TYR . 32.6 t -64.56 -50.43 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.705 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.016 HD21 HD11 ' A' ' 62' ' ' ILE . 18.0 mt -60.62 -40.66 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.514 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.71 -39.07 87.18 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.329 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.6 mmt -60.71 -52.08 66.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.349 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.595 ' CG ' HD11 ' A' ' 42' ' ' LEU . 8.7 t80 -53.53 -40.82 65.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.323 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -74.39 -38.2 63.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.86 0.362 . . . . 0.0 111.354 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -54.87 5.89 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -86.22 -25.56 25.54 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.52 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.4 mmt 61.56 35.11 17.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 110.655 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.51 ' HB3' HG23 ' A' ' 41' ' ' VAL . 9.7 t0 -114.97 124.56 51.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.855 ' O ' HG23 ' A' ' 43' ' ' VAL . 15.8 t -76.74 -12.64 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.192 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.15 -36.05 55.58 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 120.948 0.404 . . . . 0.0 110.287 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.51 HG23 ' HB3' ' A' ' 38' ' ' ASP . 34.8 t -70.13 -34.93 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.129 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.78 ' CD2' HG12 ' A' ' 29' ' ' VAL . 7.3 mt -66.61 -49.18 67.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.585 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 39' ' ' VAL . 26.2 t -58.15 -37.48 62.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.073 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.26 -59.58 8.74 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.826 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.593 ' HA ' HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -68.07 -42.93 79.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.889 0.376 . . . . 0.0 111.21 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' A' ' 50' ' ' ILE . 41.7 mt -50.45 -47.53 56.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -58.27 -45.23 88.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 45' ' ' ASP . 3.1 mt -53.21 -40.88 64.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.69 HG11 HD12 ' A' ' 26' ' ' LEU . 14.8 p -101.08 4.22 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.449 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.874 HG23 ' O ' ' A' ' 55' ' ' ARG . 60.0 mt -140.2 29.55 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.217 0.532 . . . . 0.0 111.219 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.481 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.4 p30 -89.2 15.73 8.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.628 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -129.59 150.12 74.8 Favored Pre-proline 0 C--N 1.333 -0.132 0 C-N-CA 121.126 -0.229 . . . . 0.0 110.491 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.478 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.68 -38.69 66.61 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.325 2.017 . . . . 0.0 111.429 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 t -69.42 -36.8 77.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.608 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.874 ' O ' HG23 ' A' ' 50' ' ' ILE . 53.5 mtt85 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.647 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.682 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.1 mt -53.45 -49.78 86.55 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.682 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.7 Cg_endo -41.16 -27.91 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.022 2.482 . . . . 0.0 113.493 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.594 ' CD2' HG13 ' A' ' 13' ' ' VAL . 6.7 mt -70.74 -35.27 72.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.782 0.325 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.428 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -58.04 -44.73 87.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.265 179.325 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.2 OUTLIER -75.31 -31.08 60.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.675 179.512 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.93 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.31 -59.85 4.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 1.016 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.52 -38.04 76.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.34 -179.241 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.453 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -38.13 -66.29 0.31 Allowed Pre-proline 0 N--CA 1.469 0.476 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.772 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 82.3 Cg_exo -38.69 -32.12 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.835 2.357 . . . . 0.0 113.512 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.87 HD12 HG13 ' A' ' 62' ' ' ILE . 19.4 mt -65.44 -46.47 79.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.656 0.741 . . . . 0.0 109.851 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.472 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -54.52 133.47 63.4 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.18 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.74 165.56 0.73 Allowed 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.496 2.131 . . . . 0.0 112.168 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.2 tp -56.59 -57.09 13.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.979 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -57.86 -52.17 66.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.117 0.485 . . . . 0.0 110.388 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 22.7 m170 -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.452 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.26 -43.5 98.7 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.188 179.398 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.8 -45.87 97.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.118 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.14 93.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.072 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.403 ' OH ' ' CD2' ' A' ' 59' ' ' PHE . 53.5 t80 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.324 179.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt . . . . . 0 C--O 1.233 0.191 0 CA-C-O 120.831 0.348 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.65 ' HA ' HD13 ' A' ' 65' ' ' LEU . 0.4 OUTLIER -52.02 -39.47 59.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.843 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.43 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 28.2 ttpp -61.01 -42.46 98.5 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.598 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.23 -38.48 83.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.897 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.055 HG22 ' HB1' ' A' ' 6' ' ' ALA . 23.8 t -68.03 -37.08 77.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.362 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.526 HD22 ' HB3' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -61.92 -44.06 97.56 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 178.993 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.51 -36.82 84.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.606 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 179.801 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.1 ttt-85 . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 120.801 0.334 . . . . 0.0 110.959 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -35.43 81.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.39 -40.13 85.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.99 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.701 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.78 -50.95 54.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 5.7 ttp180 -66.15 -26.9 67.64 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.12 179.306 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -71.69 -48.93 44.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.408 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.644 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.5 -43.02 73.98 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.089 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -43.3 90.17 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.664 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.409 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -57.27 -42.26 81.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.866 178.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -59.32 -36.81 76.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.157 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.88 HG22 HD22 ' A' ' 58' ' ' LEU . 46.2 t -60.24 -46.68 94.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.315 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -57.6 -41.48 81.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.153 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.0 -31.77 70.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.603 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.5 mt -97.18 6.03 49.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.406 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.663 ' O ' HG22 ' A' ' 17' ' ' ILE . 37.5 mm -145.32 67.78 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 121.721 0.772 . . . . 0.0 110.029 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.64 -33.81 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.927 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.48 165.8 13.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.654 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -101.65 -32.97 10.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.985 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.19 74.37 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.419 ' HB2' HG23 ' A' ' 17' ' ' ILE . 5.1 mt-10 -50.77 -34.57 27.8 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 36.5 mttt -72.91 -34.82 66.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.897 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -63.78 -42.69 97.71 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.227 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.838 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 t80 -64.83 -45.16 87.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' HG21 ' A' ' 49' ' ' VAL . 7.9 mt -60.66 -38.98 86.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.501 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.7 m-85 -61.34 -44.63 96.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.588 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.68 -33.96 77.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.597 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.838 HG23 ' O ' ' A' ' 25' ' ' TYR . 42.3 t -65.52 -47.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.796 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.021 HD21 HD11 ' A' ' 62' ' ' ILE . 6.2 mt -61.84 -42.71 99.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.661 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.18 -40.87 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.493 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -47.02 86.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.144 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.78 ' CD2' HD22 ' B' ' 101' ' ' LEU . 4.9 t80 -55.58 -46.45 77.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.875 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -74.9 -33.63 62.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.578 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -77.3 -55.05 5.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.9 p -89.51 -10.82 44.83 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.444 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.8 mmt 59.63 24.51 13.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.731 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.76 ' HB3' HG23 ' A' ' 41' ' ' VAL . 5.1 m-20 -101.09 117.44 35.03 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.975 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.817 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.3 t -79.86 -21.93 11.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.009 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.61 -28.43 56.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.766 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.76 HG23 ' HB3' ' A' ' 38' ' ' ASP . 43.7 t -73.46 -44.19 54.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.759 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 46' ' ' LEU . 2.4 pp -68.4 -38.39 81.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.74 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.817 HG23 ' O ' ' A' ' 39' ' ' VAL . 91.5 t -63.95 -42.28 95.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.336 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.81 -58.36 14.63 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.165 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.403 ' CB ' HG22 ' A' ' 29' ' ' VAL . 6.2 m-20 -60.54 -40.17 90.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.975 0.417 . . . . 0.0 110.709 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 42' ' ' LEU . 12.3 mt -51.9 -43.19 63.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.608 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HD3' ' CZ ' ' A' ' 59' ' ' PHE . 1.6 tppt? -57.9 -47.48 82.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.14 0.495 . . . . 0.0 110.514 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.25 -36.39 63.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.71 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.566 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.9 p -101.22 2.25 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.553 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.908 HG23 ' O ' ' A' ' 55' ' ' ARG . 53.4 mt -140.15 29.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-O 121.29 0.566 . . . . 0.0 110.869 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.473 ' N ' ' O ' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -87.24 17.59 4.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.966 -179.869 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.407 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 3.5 mt-10 -128.36 142.2 43.9 Favored Pre-proline 0 CA--C 1.523 -0.07 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.54 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.575 ' HA ' HD12 ' A' ' 56' ' ' LEU . 81.8 Cg_exo -46.75 -38.26 22.38 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.148 1.899 . . . . 0.0 111.498 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -35.66 76.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.583 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.908 ' O ' HG23 ' A' ' 50' ' ' ILE . 18.9 mtt85 -90.83 -7.22 52.91 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.808 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 53' ' ' PRO . 13.3 mt -57.15 -46.02 99.88 Favored Pre-proline 0 CA--C 1.531 0.244 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.49 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 91.2 Cg_exo -43.77 -26.76 1.33 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.766 2.31 . . . . 0.0 113.729 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.88 HD22 HG22 ' A' ' 13' ' ' VAL . 8.5 mt -73.44 -30.29 63.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.757 0.313 . . . . 0.0 111.015 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.478 ' CZ ' ' HD3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -60.99 -48.45 81.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.618 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.442 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.9 OUTLIER -75.19 -31.0 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.77 179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.483 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.73 -58.2 9.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.776 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 1.021 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.92 -36.85 77.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.957 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.436 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 1.1 ttp85 -36.5 -62.82 0.49 Allowed Pre-proline 0 N--CA 1.469 0.489 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.454 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.6 Cg_exo -33.97 -36.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.406 2.737 . . . . 0.0 113.545 -179.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.723 HD11 HG21 ' B' ' 104' ' ' VAL . 15.2 mt -65.09 -56.8 10.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.413 0.625 . . . . 0.0 109.951 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.457 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -44.24 133.65 4.4 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.187 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -50.94 165.34 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.607 2.205 . . . . 0.0 112.437 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.98 -55.38 33.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.05 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.626 ' O ' HG12 ' A' ' 72' ' ' VAL . 19.1 tttm -57.52 -53.97 52.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.178 0.513 . . . . 0.0 110.342 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.537 ' CG ' HG21 ' A' ' 39' ' ' VAL . 44.5 m170 -60.99 -22.22 64.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.482 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.11 -54.93 16.78 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.974 0.416 . . . . 0.0 110.454 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.4 p -59.18 -35.11 55.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.183 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -68.47 -37.37 80.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.968 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.547 ' CD2' HG22 ' A' ' 43' ' ' VAL . 9.5 t80 . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.216 179.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.403 ' HB3' ' CD2' ' A' ' 65' ' ' LEU . 10.9 mt . . . . . 0 C--O 1.233 0.213 0 CA-C-O 120.844 0.354 . . . . 0.0 110.972 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.78 HD22 ' CD2' ' A' ' 33' ' ' TYR . 53.2 tp -51.77 -52.76 46.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.459 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -57.15 -31.57 65.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.595 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.22 -40.26 95.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.723 HG21 HD11 ' A' ' 65' ' ' LEU . 2.0 t -70.94 -36.17 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.929 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.574 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.3 OUTLIER -72.0 -45.51 60.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.847 0.356 . . . . 0.0 110.484 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -70.06 -33.82 72.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.774 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.756 179.816 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.7 mtt85 . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 120.888 0.375 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -33.58 71.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.514 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.04 -39.3 71.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.1 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.987 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.09 -50.91 60.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -64.91 -26.9 68.51 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.188 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -70.61 -49.12 51.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.526 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.81 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.75 -43.57 72.0 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.083 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.93 -41.82 88.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.736 178.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -58.7 -42.3 88.27 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.784 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -59.91 -36.0 76.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.01 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 9' ' ' PHE . 45.0 t -60.5 -49.09 85.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.519 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -57.63 -38.74 75.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.308 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.95 -35.3 76.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.421 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 17' ' ' ILE . 74.2 mt -95.25 5.44 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.46 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.585 ' O ' HG22 ' A' ' 17' ' ' ILE . 40.5 mm -147.61 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 121.611 0.719 . . . . 0.0 110.224 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -56.42 -39.72 73.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.891 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.17 179.17 0.15 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.681 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -111.44 -32.26 6.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.2 -53.02 62.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.538 ' HB2' HG23 ' A' ' 17' ' ' ILE . 37.5 mt-10 -50.81 -35.04 30.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 7.2 mttt -73.25 -34.26 65.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.904 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.48 -41.27 98.57 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.638 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -65.08 -46.07 82.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.218 179.33 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.429 HD22 HG11 ' A' ' 13' ' ' VAL . 5.1 tp -60.55 -36.6 78.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.65 ' HA ' HD12 ' A' ' 30' ' ' LEU . 21.8 m-85 -62.83 -44.86 95.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.615 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.2 -40.55 90.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.548 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 25' ' ' TYR . 22.2 t -60.29 -47.88 90.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.921 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.846 HD21 HD11 ' A' ' 62' ' ' ILE . 4.8 mt -59.87 -44.71 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.45 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -32.99 69.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.348 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.445 ' O ' ' N ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -64.48 -55.36 21.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.283 179.563 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.485 ' HB3' HD21 ' B' ' 101' ' ' LEU . 0.1 OUTLIER -53.45 -34.45 57.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -74.85 -53.38 9.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.523 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.27 -55.18 5.64 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' MET . 17.8 p -86.67 -47.64 8.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.658 0.266 . . . . 0.0 111.583 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 75.45 32.41 0.72 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.863 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.709 ' O ' HD12 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -101.24 120.19 39.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.749 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.915 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.3 t -78.22 -16.54 13.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.252 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -36.55 53.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.99 0.424 . . . . 0.0 110.327 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 38' ' ' ASP . 26.3 t -72.81 -34.17 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.018 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.709 HD12 ' O ' ' A' ' 38' ' ' ASP . 0.2 OUTLIER -67.9 -44.31 77.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.89 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.915 HG23 ' O ' ' A' ' 39' ' ' VAL . 59.5 t -57.46 -40.0 72.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.816 0.341 . . . . 0.0 110.925 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.49 -57.68 10.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.757 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.46 ' HB3' HG22 ' A' ' 29' ' ' VAL . 2.1 m-20 -63.61 -48.91 75.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.999 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HG ' HG11 ' A' ' 29' ' ' VAL . 51.2 mt -50.48 -44.45 55.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.016 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.39 -46.64 89.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.094 0.473 . . . . 0.0 110.463 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mt -51.98 -37.63 53.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.699 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.584 HG13 HG13 ' A' ' 50' ' ' ILE . 14.8 p -101.11 1.74 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.454 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.868 HG23 ' O ' ' A' ' 55' ' ' ARG . 58.3 mt -135.13 27.41 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.304 0.573 . . . . 0.0 111.136 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 2.4 m120 -84.39 12.08 7.4 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.885 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -126.29 145.41 52.53 Favored Pre-proline 0 C--O 1.231 0.11 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.767 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.425 ' HA ' HD12 ' A' ' 56' ' ' LEU . 71.9 Cg_exo -47.95 -38.81 31.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.318 2.012 . . . . 0.0 111.692 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 p -69.27 -35.94 76.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.545 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.868 ' O ' HG23 ' A' ' 50' ' ' ILE . 63.3 mtt85 -88.02 -8.55 55.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.636 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.636 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 16.6 mt -55.43 -53.48 61.71 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.531 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.636 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.2 Cg_exo -39.04 -29.19 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.362 2.708 . . . . 0.0 113.641 -179.417 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.714 HD12 HG12 ' A' ' 50' ' ' ILE . 35.7 mt -60.94 -37.03 80.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -44.1 97.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.585 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.447 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.9 m-20 -75.0 -31.18 61.34 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.647 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.81 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.82 -62.31 1.73 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.752 -179.486 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.846 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.84 -35.06 71.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.055 -179.173 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.479 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 5.8 ttt-85 -38.05 -65.32 0.38 Allowed Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 76.7 Cg_exo -36.16 -33.7 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 123.084 2.523 . . . . 0.0 113.406 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.607 HD11 ' CE2' ' A' ' 9' ' ' PHE . 16.5 mt -65.14 -51.68 59.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.349 0.595 . . . . 0.0 110.128 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.522 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -45.08 132.15 5.47 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.351 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.472 ' HG2' ' HB2' ' A' ' 70' ' ' HIS . 2.8 Cg_endo -48.25 165.68 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.61 2.206 . . . . 0.0 112.123 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.1 tp -55.39 -56.12 23.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.419 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.1 pttt -56.3 -52.62 63.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.522 ' CB ' HG23 ' A' ' 66' ' ' ILE . 25.0 m170 -62.88 -29.19 70.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.477 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.03 -43.88 87.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.016 0.436 . . . . 0.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 t -67.85 -47.76 78.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.269 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.81 -27.9 69.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.508 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.591 ' OH ' HD13 ' A' ' 46' ' ' LEU . 23.0 t80 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.694 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.3 mt . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.811 0.338 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.513 ' HA ' HD13 ' A' ' 65' ' ' LEU . 40.5 tp -51.92 -52.62 48.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.99 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.424 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.0 OUTLIER -54.99 -35.35 64.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.923 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.04 -38.57 91.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.987 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.1 t -69.8 -34.24 59.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.102 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.492 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.1 mt -64.44 -45.61 86.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.957 0.408 . . . . 0.0 109.959 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -35.19 80.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.566 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.575 179.746 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.689 0.281 . . . . 0.0 111.643 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -34.75 72.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.811 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.42 -37.58 80.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.025 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.04 -49.84 53.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.717 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -26.71 68.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.335 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -70.06 -49.31 52.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.449 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.608 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -69.86 -42.54 73.38 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.951 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.1 ttp85 -57.47 -44.1 84.6 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.664 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.8 -43.33 85.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.209 0.528 . . . . 0.0 109.789 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -59.18 -35.23 73.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.193 179.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.806 HG22 HD23 ' A' ' 58' ' ' LEU . 61.5 t -62.05 -46.65 96.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.271 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -57.59 -39.3 76.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.005 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -69.07 -36.1 77.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.541 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.401 HD13 ' HG2' ' A' ' 57' ' ' PRO . 14.6 mt -96.49 8.39 44.21 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.572 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.666 ' O ' HG22 ' A' ' 17' ' ' ILE . 34.5 mm -150.06 69.53 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-O 121.625 0.726 . . . . 0.0 109.986 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.85 -33.52 70.53 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.03 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -60.89 175.47 0.49 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -110.26 -30.44 7.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.71 -51.23 63.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.973 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' A' ' 17' ' ' ILE . 35.1 mt-10 -50.78 -34.69 28.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 73.4 mttt -72.14 -35.5 69.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.003 178.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.45 -40.66 97.35 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.049 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.304 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.589 HD12 HG21 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.71 -38.62 78.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.56 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 14.1 m-30 -64.73 -45.43 86.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.7 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.74 -38.04 89.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.886 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 25' ' ' TYR . 36.3 t -63.0 -50.71 78.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.016 0.436 . . . . 0.0 110.952 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.96 HD21 HD11 ' A' ' 62' ' ' ILE . 13.0 mt -62.71 -40.41 97.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.483 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -65.36 -40.55 93.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.4 tpt -62.21 -44.85 95.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.371 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.711 ' CD2' HD13 ' B' ' 101' ' ' LEU . 6.3 t80 -57.45 -45.09 85.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.017 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -74.59 -33.67 62.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -55.0 5.8 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.25 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -82.33 -19.8 38.63 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 3.7 mmt 63.36 26.82 15.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.883 0.373 . . . . 0.0 110.652 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -114.06 121.39 43.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.81 ' O ' HG23 ' A' ' 43' ' ' VAL . 22.0 t -78.38 -16.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.238 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.78 54.79 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.915 0.388 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.53 -43.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.793 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.672 HD12 HD12 ' A' ' 46' ' ' LEU . 3.4 pp -69.01 -38.28 79.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.629 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 39' ' ' VAL . 79.5 t -61.56 -44.34 98.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.942 0.401 . . . . 0.0 110.377 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.31 -58.89 11.69 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.243 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.569 ' HA ' HD12 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -60.55 -39.32 87.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.819 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.771 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.0 mt -52.35 -45.02 65.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -57.36 -48.63 78.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.337 179.469 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.569 HD12 ' HA ' ' A' ' 45' ' ' ASP . 0.9 OUTLIER -51.07 -39.46 56.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.873 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 49' ' ' VAL . 10.9 p -100.94 4.93 10.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.42 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.871 HG23 ' O ' ' A' ' 55' ' ' ARG . 62.3 mt -138.34 27.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.257 0.551 . . . . 0.0 110.868 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 47' ' ' LYS . 2.2 m120 -84.69 12.59 6.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.835 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -125.37 148.31 60.71 Favored Pre-proline 0 C--N 1.334 -0.083 0 C-N-CA 121.13 -0.228 . . . . 0.0 110.552 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.491 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.79 -38.14 66.77 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.37 2.047 . . . . 0.0 111.466 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.6 p -69.54 -32.7 71.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.47 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.871 ' O ' HG23 ' A' ' 50' ' ' ILE . 86.2 mtt180 -90.57 -11.46 39.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.572 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.5 mt -55.97 -45.91 99.83 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.675 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.486 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.9 Cg_exo -44.32 -24.88 1.1 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.786 2.324 . . . . 0.0 113.532 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.806 HD23 HG22 ' A' ' 13' ' ' VAL . 6.9 mt -73.12 -35.35 66.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.747 0.308 . . . . 0.0 110.984 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -59.06 -46.04 89.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 0.0 110.751 179.92 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.433 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.3 m-20 -75.04 -30.95 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.85 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.582 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -64.96 -63.39 1.12 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.984 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.96 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -59.03 -37.42 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.457 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.7 mtm180 -38.45 -66.39 0.31 Allowed Pre-proline 0 N--CA 1.468 0.444 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 79.3 Cg_exo -37.05 -30.69 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.214 2.609 . . . . 0.0 113.54 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.608 HD11 ' CE2' ' A' ' 9' ' ' PHE . 16.2 mt -65.18 -49.82 68.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.524 0.678 . . . . 0.0 109.651 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.537 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -53.07 138.42 46.12 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.744 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -48.34 165.46 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.691 2.26 . . . . 0.0 112.427 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.435 ' O ' HG23 ' A' ' 72' ' ' VAL . 3.6 tp -56.93 -57.11 13.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.967 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -57.13 -53.59 56.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.129 0.49 . . . . 0.0 110.251 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.537 ' CB ' HG23 ' A' ' 66' ' ' ILE . 24.1 m170 -59.21 -28.73 66.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.451 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.31 -42.23 93.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 68' ' ' LEU . 23.3 t -62.89 -42.78 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.497 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -64.46 -45.68 86.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.341 179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.645 ' CD2' HG22 ' A' ' 43' ' ' VAL . 8.5 t80 . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.375 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.796 0.331 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.711 HD13 ' CD2' ' A' ' 33' ' ' TYR . 2.6 pt? -51.81 -43.84 63.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.848 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.458 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 8.6 tttp -59.34 -33.91 71.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.382 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -68.1 -36.45 79.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.56 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.025 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.9 t -68.37 -34.15 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.868 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -68.4 -45.55 72.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.423 179.451 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.32 -39.87 92.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.648 179.873 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.797 0.332 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.4 -37.97 79.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.008 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t -58.07 -42.5 83.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.208 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.048 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -65.33 -50.95 63.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.995 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -26.79 69.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.315 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -70.12 -49.11 54.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.591 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.73 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.4 -42.67 71.35 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 179.012 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -58.44 -42.04 86.47 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.656 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -59.06 -46.15 88.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.453 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.412 ' HG2' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -60.38 -31.72 70.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.403 179.611 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.799 HG22 ' CD2' ' A' ' 58' ' ' LEU . 47.6 t -63.64 -48.05 88.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.36 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.62 -41.31 81.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -69.15 -35.23 76.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.315 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.2 mt -93.38 6.95 46.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.525 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.673 ' O ' HG22 ' A' ' 17' ' ' ILE . 39.1 mm -142.31 66.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-O 121.782 0.801 . . . . 0.0 109.98 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -51.43 -31.57 23.5 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.044 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.73 170.66 11.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.719 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.01 -30.13 9.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.95 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.96 -50.26 72.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.014 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.4 ' HB2' HG23 ' A' ' 17' ' ' ILE . 8.6 mt-10 -50.72 -34.59 27.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.36 0.6 . . . . 0.0 109.397 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 33.6 mttt -71.75 -35.59 70.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.935 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.49 -42.55 99.57 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.19 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.879 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -64.72 -44.6 89.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.403 179.491 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.676 HD12 HG21 ' A' ' 49' ' ' VAL . 0.5 OUTLIER -59.52 -36.51 76.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.711 179.637 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 12.8 m-30 -64.19 -48.52 75.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.617 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.32 -38.64 80.8 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.784 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.879 HG23 ' O ' ' A' ' 25' ' ' TYR . 11.5 t -60.86 -52.54 60.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.08 0.467 . . . . 0.0 110.793 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.702 HD21 HD11 ' A' ' 62' ' ' ILE . 28.5 mt -59.58 -42.97 93.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.317 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.98 -36.71 70.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.474 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 1.8 mmt -63.56 -48.37 77.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.105 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.623 ' HB3' HD21 ' B' ' 101' ' ' LEU . 0.1 OUTLIER -53.39 -39.44 64.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.0 179.634 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.443 ' HD2' HD23 ' B' ' 101' ' ' LEU . 1.0 OUTLIER -74.85 -46.13 38.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.84 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.474 ' HG2' ' HA ' ' A' ' 32' ' ' MET . 1.2 pt20 -77.54 -52.68 8.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -178.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.4 p -92.78 -31.76 14.92 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.521 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 4.7 mmt 63.77 31.19 14.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.979 0.419 . . . . 0.0 110.79 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD2' ' HB3' ' A' ' 40' ' ' ALA . 2.2 t70 -104.87 118.51 36.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.917 ' O ' HG23 ' A' ' 43' ' ' VAL . 20.6 t -77.95 -14.61 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.463 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.455 ' HB3' ' OD2' ' A' ' 38' ' ' ASP . . . -76.07 -34.07 59.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 110.324 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.3 t -72.61 -37.76 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.203 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.541 ' O ' HD12 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -65.24 -44.41 88.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.937 179.684 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.917 HG23 ' O ' ' A' ' 39' ' ' VAL . 56.5 t -54.56 -43.66 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-O 120.796 0.332 . . . . 0.0 111.2 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.38 -56.41 15.64 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.688 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.507 ' HB3' HG22 ' A' ' 29' ' ' VAL . 1.8 m-20 -59.43 -52.19 66.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.866 0.365 . . . . 0.0 111.1 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.663 HD23 ' CD1' ' A' ' 50' ' ' ILE . 0.7 OUTLIER -50.42 -45.01 55.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.073 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.47 ' O ' ' N ' ' A' ' 51' ' ' ASN . 6.0 mttp -57.62 -48.39 79.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.118 0.485 . . . . 0.0 110.704 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 45' ' ' ASP . 10.8 mt -54.1 -37.56 64.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.676 HG21 HD12 ' A' ' 26' ' ' LEU . 10.4 p -101.04 3.47 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.332 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.902 HG23 ' O ' ' A' ' 55' ' ' ARG . 61.4 mt -139.18 27.86 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-O 121.305 0.574 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.47 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -88.6 16.86 6.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.72 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.414 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 18.9 mm-40 -128.94 142.87 46.59 Favored Pre-proline 0 C--N 1.335 -0.046 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.579 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 56' ' ' LEU . 87.1 Cg_exo -45.68 -39.16 17.88 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.254 1.97 . . . . 0.0 111.927 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -69.12 -34.84 75.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.719 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.902 ' O ' HG23 ' A' ' 50' ' ' ILE . 46.8 mtt85 -91.78 -9.71 42.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.91 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.491 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.5 mt -55.28 -46.12 99.74 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.651 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.47 -25.69 2.34 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.78 2.32 . . . . 0.0 113.523 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.799 ' CD2' HG22 ' A' ' 13' ' ' VAL . 3.4 mt -73.81 -34.15 64.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.85 0.357 . . . . 0.0 111.03 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.553 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -59.93 -50.86 72.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.436 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 5.0 t0 -75.2 -31.16 60.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.73 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.85 -53.67 54.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.052 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.702 HD11 HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -66.15 -36.78 78.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.906 0.384 . . . . 0.0 111.75 -179.571 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.402 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -35.51 -61.24 0.54 Allowed Pre-proline 0 N--CA 1.469 0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.294 -179.234 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.436 ' CD ' ' O ' ' A' ' 60' ' ' ASP . 75.8 Cg_exo -34.75 -33.98 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.511 2.807 . . . . 0.0 113.467 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.503 HD11 HG21 ' B' ' 104' ' ' VAL . 15.1 mt -65.2 -53.97 36.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.596 0.712 . . . . 0.0 109.525 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -46.41 136.64 7.13 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.135 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -67.18 165.7 25.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.448 2.098 . . . . 0.0 112.028 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 72' ' ' VAL . 3.9 tp -51.13 -50.37 59.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.174 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -58.43 8.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.919 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.547 ' HB2' HG23 ' A' ' 66' ' ' ILE . 18.2 m170 -62.05 -25.79 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.397 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.28 -42.33 99.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.017 0.437 . . . . 0.0 110.047 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 68' ' ' LEU . 35.1 t -67.74 -44.74 85.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.424 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -67.22 -33.76 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.408 ' OH ' ' CD2' ' A' ' 59' ' ' PHE . 50.8 t80 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.328 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.498 ' O ' HG23 ' B' ' 104' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.753 0.311 . . . . 0.0 111.05 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.623 HD21 ' HB3' ' A' ' 33' ' ' TYR . 3.3 tp -56.18 -52.62 63.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.986 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.479 ' HA ' HD21 ' B' ' 105' ' ' LEU . 18.2 tttp -63.07 -31.56 72.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.24 -44.66 91.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.323 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.048 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.7 t -66.08 -54.2 29.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.227 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.674 HD12 ' N ' ' B' ' 106' ' ' GLU . 4.4 pp -61.75 -32.88 73.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 106' ' ' GLU . . . . . 0.674 ' N ' HD12 ' B' ' 105' ' ' LEU . 46.3 tt0 -73.96 -40.35 63.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.717 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 179.901 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.721 0.296 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.78 -34.24 71.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.765 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -66.44 -35.1 74.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.75 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.99 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -70.01 -50.26 43.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.975 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -26.78 68.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.249 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.53 -49.11 51.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.389 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.66 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -69.55 -43.99 71.82 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.058 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.668 HH21 HG11 ' A' ' 13' ' ' VAL . 5.1 tpm_? -59.07 -40.82 86.38 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.581 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -59.33 -42.49 91.58 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.831 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.6 mttp -60.39 -37.23 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.272 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.795 HG13 HD22 ' A' ' 58' ' ' LEU . 41.9 t -59.9 -48.93 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -57.62 -39.07 76.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.219 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -69.05 -32.45 71.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.481 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.0 mt -100.42 8.53 43.54 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.529 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.693 ' O ' HG22 ' A' ' 17' ' ' ILE . 35.3 mm -147.02 68.52 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.702 0.763 . . . . 0.0 110.051 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -58.78 -33.37 70.24 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.891 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -72.72 139.15 47.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.742 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -75.46 -28.87 59.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.033 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -52.65 64.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.032 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.604 ' HB2' HG23 ' A' ' 17' ' ' ILE . 25.7 mt-10 -50.98 -34.76 30.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 17.7 mttp -72.21 -34.25 68.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.887 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -61.61 -41.8 97.98 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.188 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.906 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -67.76 -42.08 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.291 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.5 mt -63.1 -39.01 93.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.532 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.401 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.7 m-85 -62.67 -44.48 96.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.63 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -63.5 -44.51 94.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.547 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 25' ' ' TYR . 21.6 t -59.46 -46.49 92.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.07 HD21 HD11 ' A' ' 62' ' ' ILE . 3.8 mt -59.7 -44.41 93.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.426 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.86 -36.24 72.07 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.508 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.428 ' O ' ' N ' ' A' ' 36' ' ' THR . 25.8 mtp -63.35 -48.94 75.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.139 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.454 ' CE2' HG13 ' A' ' 66' ' ' ILE . 0.1 OUTLIER -53.54 -42.55 67.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.878 0.37 . . . . 0.0 110.883 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -44.55 49.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.869 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -77.34 -55.01 5.76 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.428 ' N ' ' O ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -92.2 -43.39 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -178.666 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.442 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.5 ttt 74.51 32.98 0.88 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.853 0.359 . . . . 0.0 110.652 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.707 ' O ' HD12 ' A' ' 42' ' ' LEU . 9.9 p30 -98.14 115.92 29.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.555 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.895 ' O ' HG23 ' A' ' 43' ' ' VAL . 20.8 t -79.2 -16.63 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.447 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.88 -37.68 47.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.017 0.437 . . . . 0.0 110.478 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.533 HG21 ' OD2' ' A' ' 38' ' ' ASP . 25.4 t -73.56 -34.06 40.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.279 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.707 HD12 ' O ' ' A' ' 38' ' ' ASP . 0.2 OUTLIER -69.51 -41.37 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.803 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 39' ' ' VAL . 95.0 t -60.0 -40.06 82.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.639 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.17 -57.27 12.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.449 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.55 -48.66 76.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.871 0.367 . . . . 0.0 110.908 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.56 ' HG ' HG11 ' A' ' 29' ' ' VAL . 65.6 mt -50.52 -41.93 54.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.874 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -62.15 -44.94 95.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.105 0.478 . . . . 0.0 110.435 179.621 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -54.95 -37.05 65.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.76 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.693 HG13 HG13 ' A' ' 50' ' ' ILE . 15.0 p -101.12 -0.78 10.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.394 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.882 HG23 ' O ' ' A' ' 55' ' ' ARG . 49.0 mt -136.64 29.46 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.083 0.468 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -89.31 16.53 7.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.674 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -131.01 143.7 50.52 Favored Pre-proline 0 C--N 1.333 -0.112 0 CA-C-O 120.561 0.22 . . . . 0.0 110.435 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.521 ' HA ' HD12 ' A' ' 56' ' ' LEU . 86.7 Cg_exo -46.25 -39.49 21.19 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.343 2.029 . . . . 0.0 111.974 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 m -69.21 -33.55 73.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.624 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.882 ' O ' HG23 ' A' ' 50' ' ' ILE . 11.2 mtp180 -89.87 -12.04 40.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.477 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.8 mt -53.78 -46.07 98.56 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 94.1 Cg_exo -43.72 -27.21 1.44 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.706 2.271 . . . . 0.0 113.736 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.795 HD22 HG13 ' A' ' 13' ' ' VAL . 14.9 mt -73.72 -34.23 64.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 111.139 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.72 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -65.96 -45.84 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 110.888 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.32 -31.48 60.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.832 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.536 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.35 -63.06 1.35 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.732 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 1.07 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.71 -30.86 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.971 0.415 . . . . 0.0 111.648 -179.619 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.498 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 25.1 ttp180 -40.18 -60.26 1.54 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.498 ' CD ' ' HB3' ' A' ' 63' ' ' ARG . 6.7 Cg_endo -48.76 -25.64 8.5 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.69 2.26 . . . . 0.0 113.28 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.66 HD11 ' CE2' ' A' ' 9' ' ' PHE . 26.1 mt -65.57 -45.25 84.02 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.568 0.699 . . . . 0.0 109.575 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.637 HG23 ' HB2' ' A' ' 70' ' ' HIS . 1.3 mp -50.7 136.43 25.65 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.149 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -61.39 165.78 12.47 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.576 2.184 . . . . 0.0 112.188 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.511 ' O ' HG23 ' A' ' 72' ' ' VAL . 16.8 mt -52.01 -49.76 62.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.467 -179.502 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -56.75 -61.35 2.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.162 0.506 . . . . 0.0 110.681 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.637 ' HB2' HG23 ' A' ' 66' ' ' ILE . 16.0 m170 -60.23 -26.66 66.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -60.81 -46.95 88.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.041 0.448 . . . . 0.0 109.896 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 68' ' ' LEU . 20.0 t -62.23 -45.0 99.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.935 179.016 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.12 -31.35 72.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.32 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.405 ' OH ' HD13 ' A' ' 46' ' ' LEU . 4.2 t80 . . . . . 0 C--N 1.332 -0.18 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.67 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.411 HD22 ' CD2' ' A' ' 65' ' ' LEU . 2.7 mt . . . . . 0 N--CA 1.463 0.182 0 CA-C-O 120.715 0.293 . . . . 0.0 111.253 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 26.3 tp -53.35 -52.75 58.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.959 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -56.68 -31.66 64.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -67.63 -38.41 83.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.977 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.99 HG22 ' HB1' ' A' ' 6' ' ' ALA . 23.9 t -70.85 -34.93 57.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.482 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.533 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.5 OUTLIER -67.26 -45.62 76.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.425 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -73.61 -33.71 64.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.726 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.794 179.984 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.865 0.364 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -59.28 -33.52 71.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.9 t -61.61 -39.19 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.0 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.52 -50.96 56.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.183 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -66.68 -26.88 67.25 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.069 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -71.63 -48.93 44.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.372 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.918 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.32 -44.04 72.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.016 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.47 -41.13 89.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.838 178.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -58.46 -43.0 88.69 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.8 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -60.7 -35.47 76.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 1.056 HG13 HD21 ' A' ' 58' ' ' LEU . 54.8 t -60.71 -48.46 88.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.465 179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.62 -41.33 81.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.191 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -69.14 -32.61 72.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.472 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.7 mt -97.99 7.47 46.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.547 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.658 ' O ' HG22 ' A' ' 17' ' ' ILE . 35.6 mm -146.59 68.63 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.931 0 CA-C-O 121.671 0.748 . . . . 0.0 109.861 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -55.92 -33.48 64.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.871 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -71.25 159.63 34.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.695 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.0 -29.78 15.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.975 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.54 -52.67 64.55 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.551 ' HB2' HG23 ' A' ' 17' ' ' ILE . 12.5 mt-10 -50.8 -34.77 28.93 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -72.88 -34.17 66.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.944 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -64.88 -44.67 88.92 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.249 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.883 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.8 -40.18 94.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.249 179.371 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.603 HD11 HD22 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -64.12 -39.73 94.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.492 179.595 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -60.89 -43.57 98.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.481 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -64.81 -36.29 83.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.547 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 25' ' ' TYR . 28.0 t -65.62 -45.41 92.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.019 HD21 HD11 ' A' ' 62' ' ' ILE . 12.9 mt -65.52 -43.3 90.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.522 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -63.63 -31.11 72.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.42 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -52.1 35.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.378 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.565 ' CG ' HD12 ' A' ' 42' ' ' LEU . 14.8 t80 -57.55 -33.88 68.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.996 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -74.57 -41.6 60.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.994 0.426 . . . . 0.0 111.018 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -77.45 -54.99 5.76 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.38 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 p -81.67 -28.79 33.37 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.518 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.0 mmt 64.13 35.46 10.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 110.607 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -118.21 124.23 47.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.883 ' O ' HG23 ' A' ' 43' ' ' VAL . 4.7 t -77.63 -7.37 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.377 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -38.56 47.99 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.05 0.453 . . . . 0.0 110.269 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.25 -33.98 60.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.99 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.89 HD22 HD11 ' A' ' 46' ' ' LEU . 1.2 mt -66.82 -49.77 64.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.884 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 39' ' ' VAL . 29.0 t -58.68 -42.87 86.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.477 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.35 -58.29 14.1 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.848 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -66.13 -40.9 91.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.258 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.89 HD11 HD22 ' A' ' 42' ' ' LEU . 20.7 mt -51.51 -47.44 63.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.096 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.48 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.76 -46.84 77.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 0.0 110.702 179.685 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.6 mt -53.57 -41.18 66.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.841 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.634 HG13 HG13 ' A' ' 50' ' ' ILE . 14.3 p -101.19 8.44 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.354 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.862 HG23 ' O ' ' A' ' 55' ' ' ARG . 71.2 mt -144.88 28.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.236 0.541 . . . . 0.0 111.094 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 47' ' ' LYS . 14.5 p30 -90.18 15.32 10.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.559 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -128.79 150.86 76.13 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.07 -39.21 70.75 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.38 2.053 . . . . 0.0 111.558 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.6 p -69.58 -34.01 73.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.806 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.862 ' O ' HG23 ' A' ' 50' ' ' ILE . 45.6 mtt180 -90.22 -12.21 38.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.69 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.485 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -53.03 -46.33 97.7 Favored Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 83.4 Cg_exo -46.65 -24.92 3.17 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.806 2.337 . . . . 0.0 113.56 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.056 HD21 HG13 ' A' ' 13' ' ' VAL . 27.8 mt -67.23 -35.3 79.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.709 0.29 . . . . 0.0 111.189 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -45.01 95.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.519 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.43 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 1.3 t0 -75.2 -31.12 60.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.848 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.918 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.25 -54.69 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.093 -179.326 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 1.019 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -71.19 -38.1 69.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.747 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.581 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 2.0 tmm_? -36.94 -55.76 1.55 Allowed Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.581 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 81.5 Cg_exo -41.16 -34.23 1.55 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.766 2.31 . . . . 0.0 112.958 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.596 HD12 HG13 ' A' ' 62' ' ' ILE . 24.3 mt -65.31 -51.28 61.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.391 0.615 . . . . 0.0 110.338 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.497 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -44.78 134.75 4.84 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.186 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.17 165.55 1.33 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.636 2.224 . . . . 0.0 112.361 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.7 tp -55.8 -55.51 31.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.952 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.07 -53.61 56.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.034 0.445 . . . . 0.0 110.403 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.497 ' CB ' HG23 ' A' ' 66' ' ' ILE . 19.2 m170 -59.62 -31.02 69.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.324 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -45.64 92.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.3 179.469 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.6 t -61.53 -47.76 91.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.096 179.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.09 -29.19 69.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.199 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.62 ' OH ' HD13 ' A' ' 46' ' ' LEU . 16.7 t80 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.651 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mt . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.906 0.384 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.813 HD11 HD23 ' A' ' 30' ' ' LEU . 11.7 tp -54.43 -52.85 60.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.827 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -57.75 -31.63 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.036 179.745 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.55 -41.02 93.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.145 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.0 HG22 ' HB1' ' A' ' 6' ' ' ALA . 25.8 t -70.47 -36.12 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.505 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.516 HD22 ' HB3' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -62.57 -45.65 91.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.91 0.386 . . . . 0.0 110.214 179.45 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -33.82 71.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.752 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.879 179.977 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.413 ' NH1' ' HB3' ' A' ' 3' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.465 0.321 0 CA-C-O 120.683 0.278 . . . . 0.0 111.541 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -59.05 -45.15 91.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.833 0.349 . . . . 0.0 111.029 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -58.98 -40.77 81.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.109 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.53 -49.03 58.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.878 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -66.11 -26.76 67.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.111 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -71.06 -49.12 48.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.375 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.724 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.25 -44.39 72.04 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.083 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.45 85.16 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -57.63 -42.43 83.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.561 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -59.98 -36.78 77.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.911 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.998 HG22 HD22 ' A' ' 58' ' ' LEU . 48.8 t -58.56 -49.73 81.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.219 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -57.68 -38.25 74.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -68.93 -39.14 79.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.469 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.466 ' O ' HD13 ' A' ' 17' ' ' ILE . 16.3 mt -93.02 7.44 44.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.434 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.644 ' O ' HG22 ' A' ' 17' ' ' ILE . 42.4 mm -148.11 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.621 0.724 . . . . 0.0 110.141 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.85 -35.65 69.09 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.951 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.97 174.36 1.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -107.49 -33.29 7.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.935 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -51.48 69.24 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.986 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.411 ' HB2' HG23 ' A' ' 17' ' ' ILE . 19.6 mt-10 -50.8 -34.82 29.14 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.448 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 4.8 mttm -71.8 -34.61 69.52 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.97 178.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.45 -44.47 96.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.169 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.829 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -64.94 -41.71 95.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.357 179.429 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.58 -42.76 93.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 15.8 m-85 -61.46 -44.44 97.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.521 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.42 -32.92 72.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.846 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.966 HG12 HD23 ' A' ' 42' ' ' LEU . 21.5 t -66.07 -51.83 55.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.905 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.045 HD21 HD11 ' A' ' 62' ' ' ILE . 32.2 mt -62.05 -36.2 80.91 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.47 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -62.35 -38.81 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.385 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.437 ' O ' HG23 ' A' ' 36' ' ' THR . 10.3 mmm -65.19 -48.04 74.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.54 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.487 ' CD1' HD12 ' A' ' 42' ' ' LEU . 11.0 t80 -57.35 -33.67 68.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -70.1 -52.61 22.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.219 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -77.46 -54.96 5.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.918 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 32' ' ' MET . 5.5 p -66.87 -38.72 86.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.893 -179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.423 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.1 mmt 64.67 28.87 13.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.84 0.352 . . . . 0.0 110.716 -179.364 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.16 127.13 53.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.866 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.8 t -75.26 -7.55 10.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.168 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.9 -36.47 56.64 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.008 0.432 . . . . 0.0 110.199 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.82 -33.97 54.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.966 HD23 HG12 ' A' ' 29' ' ' VAL . 2.3 mt -67.27 -47.77 69.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.833 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 39' ' ' VAL . 31.3 t -57.72 -45.65 86.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.555 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.84 -57.39 17.71 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.049 -179.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.801 ' HB3' HG22 ' A' ' 29' ' ' VAL . 9.0 m-20 -64.88 -42.93 94.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.705 0.288 . . . . 0.0 111.28 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.715 HD11 HD22 ' A' ' 42' ' ' LEU . 26.9 mt -50.42 -53.29 30.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.5 mttt -53.18 -48.36 68.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.873 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.9 mt -49.96 -42.95 49.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.083 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.9 p -101.09 5.72 10.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.427 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.861 HG23 ' O ' ' A' ' 55' ' ' ARG . 41.6 mt -138.19 28.39 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.329 0.585 . . . . 0.0 110.941 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 1.8 m120 -84.84 13.68 5.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.907 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -126.31 143.03 44.55 Favored Pre-proline 0 N--CA 1.457 -0.085 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.633 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 56' ' ' LEU . 83.2 Cg_exo -46.86 -38.92 23.93 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.281 1.987 . . . . 0.0 111.801 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.4 t -69.3 -32.82 72.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.582 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.861 ' O ' HG23 ' A' ' 50' ' ' ILE . 91.5 mtt180 -90.12 -12.69 37.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.547 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.495 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.5 mt -54.42 -45.98 99.2 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.495 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 98.7 Cg_exo -44.2 -30.9 3.78 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.788 2.325 . . . . 0.0 113.69 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.998 HD22 HG22 ' A' ' 13' ' ' VAL . 16.7 mt -64.6 -39.86 94.47 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.686 0.279 . . . . 0.0 111.272 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -54.5 -47.26 73.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.006 0.432 . . . . 0.0 110.627 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -75.31 -31.26 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.715 179.475 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.724 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -61.81 -57.02 13.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.907 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 1.045 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.52 -37.41 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.043 -179.177 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.442 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.3 mtp85 -36.44 -64.58 0.36 Allowed Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 73.7 Cg_exo -36.49 -33.85 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.234 2.623 . . . . 0.0 113.221 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.676 HD12 HG13 ' A' ' 62' ' ' ILE . 24.4 mt -65.13 -51.28 62.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.447 0.641 . . . . 0.0 110.117 179.521 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.506 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -45.37 135.32 5.62 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.304 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.16 165.67 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.667 2.244 . . . . 0.0 112.336 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.4 mt -56.03 -57.06 13.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.117 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.466 ' O ' HG12 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -59.68 -46.58 88.63 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.706 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.506 ' CB ' HG23 ' A' ' 66' ' ' ILE . 23.2 m170 -65.37 -25.48 67.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.476 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.46 -55.03 35.71 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.569 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.5 p -62.83 -37.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.385 179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.2 -31.69 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.362 179.318 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.581 ' OH ' HD13 ' A' ' 46' ' ' LEU . 11.4 t80 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.477 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.882 0.372 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.661 HD12 HD13 ' A' ' 65' ' ' LEU . 21.9 tp -53.99 -52.59 60.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.797 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -31.7 67.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.704 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.32 -38.81 91.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.883 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.109 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.1 t -69.66 -41.54 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.059 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.2 mt -57.61 -44.17 85.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.29 0.567 . . . . 0.0 109.909 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -73.66 -32.81 64.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.955 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.929 -179.0 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.861 0.362 . . . . 0.0 111.024 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.95 -42.79 99.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.813 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.21 -35.07 59.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.077 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.94 -51.05 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.004 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.28 -26.88 67.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.198 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.74 -45.97 60.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.456 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -70.7 -44.76 66.3 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.67 -42.77 89.25 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.15 -40.28 89.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.937 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -62.28 -36.27 81.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.06 179.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.711 HG22 HD22 ' A' ' 58' ' ' LEU . 47.2 t -59.41 -52.06 65.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.228 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -57.47 -35.22 69.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.167 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -69.01 -39.8 79.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.599 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 mt -98.12 11.17 38.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.557 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.66 ' O ' HG22 ' A' ' 17' ' ' ILE . 36.0 mm -149.44 69.12 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-O 121.692 0.758 . . . . 0.0 110.143 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -60.42 -36.77 78.95 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.739 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -62.08 140.28 58.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.704 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.88 -36.61 56.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.36 65.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.852 0.358 . . . . 0.0 111.16 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.537 ' HB2' HG23 ' A' ' 17' ' ' ILE . 47.3 mt-10 -50.68 -34.75 27.85 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.417 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 9.9 mtpt -73.26 -35.34 66.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.847 178.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.09 -39.22 94.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.007 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.884 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -68.0 -43.41 78.94 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.311 179.366 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -62.87 -45.46 92.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.677 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.4 m-85 -60.93 -37.06 80.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.675 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.78 -32.99 73.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.592 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 25' ' ' TYR . 21.5 t -72.0 -39.45 66.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.837 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.665 HD21 HD11 ' A' ' 62' ' ' ILE . 16.5 mt -69.89 -40.71 75.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.535 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -37.27 81.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.333 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.32 -46.03 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.13 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.735 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.4 t80 -60.15 -35.66 75.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.437 ' CE1' ' HE3' ' B' ' 102' ' ' LYS . 42.2 t-80 -74.58 -44.67 49.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.326 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -77.51 -54.98 5.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.162 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.3 p -74.17 -23.09 59.18 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.007 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 18.7 mmt 61.24 22.25 12.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.676 0.274 . . . . 0.0 110.798 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.616 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -98.47 116.45 30.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.707 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.752 ' HA ' HD23 ' A' ' 42' ' ' LEU . 21.6 t -80.15 -21.41 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.187 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.2 -32.46 56.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.7 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.616 HG23 ' HB3' ' A' ' 38' ' ' ASP . 39.2 t -73.4 -42.32 56.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.801 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 39' ' ' VAL . 0.4 OUTLIER -69.11 -36.15 77.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.701 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 39' ' ' VAL . 54.1 t -66.81 -43.16 89.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.023 0.44 . . . . 0.0 110.338 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.39 -56.05 27.23 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.334 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -60.99 -42.26 98.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.94 0.4 . . . . 0.0 110.719 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.804 HD22 ' CD1' ' A' ' 50' ' ' ILE . 12.2 mt -50.44 -43.74 55.18 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.743 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.3 mmtt -56.69 -50.59 71.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.245 0.545 . . . . 0.0 110.58 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -38.5 54.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.912 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 49' ' ' VAL . 12.5 p -101.15 5.49 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.416 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.856 HG23 ' O ' ' A' ' 55' ' ' ARG . 69.2 mt -141.31 29.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.272 0.558 . . . . 0.0 110.826 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 47' ' ' LYS . 1.5 m120 -82.11 9.06 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.413 ' CG ' ' CD ' ' A' ' 55' ' ' ARG . 2.8 pt-20 -132.61 153.93 81.31 Favored Pre-proline 0 N--CA 1.462 0.157 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.367 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.482 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.8 Cg_endo -51.23 -38.25 61.05 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.836 2.357 . . . . 0.0 112.168 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -32.47 72.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.411 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.856 ' O ' HG23 ' A' ' 50' ' ' ILE . 14.8 mtp180 -94.47 -10.24 32.96 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.441 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.595 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.4 mt -54.13 -54.2 50.14 Favored Pre-proline 0 C--N 1.332 -0.161 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.595 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.6 Cg_endo -41.44 -24.89 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.123 2.549 . . . . 0.0 113.841 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.711 HD22 HG22 ' A' ' 13' ' ' VAL . 17.6 mt -73.74 -31.49 63.38 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.312 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.785 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -72.36 -41.29 66.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 110.963 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.444 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 3.3 m-20 -75.03 -30.92 61.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.654 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.826 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.81 -60.08 2.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.009 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.665 HD11 HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.06 -35.84 59.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.929 -179.452 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.436 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.2 ttt-85 -41.82 -65.64 0.49 Allowed Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.126 -179.079 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.464 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.1 Cg_exo -35.57 -30.75 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.337 2.691 . . . . 0.0 113.757 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.849 HD11 ' CE2' ' A' ' 9' ' ' PHE . 25.0 mt -64.94 -50.78 65.07 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.468 0.652 . . . . 0.0 109.784 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.564 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.6 mp -41.59 127.94 2.37 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.452 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.454 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 52.9 Cg_exo -55.21 165.8 2.75 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.66 2.24 . . . . 0.0 112.175 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.502 ' O ' HG23 ' A' ' 72' ' ' VAL . 1.5 mp -52.19 -50.18 62.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.287 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -57.74 -60.6 3.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.168 0.509 . . . . 0.0 110.39 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.564 ' CB ' HG23 ' A' ' 66' ' ' ILE . 44.7 m170 -58.76 -24.23 61.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.378 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -44.43 83.36 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.087 0.47 . . . . 0.0 109.82 179.075 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 68' ' ' LEU . 28.6 t -61.58 -42.96 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.736 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 -31.74 70.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.147 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.467 ' HE1' HD11 ' A' ' 42' ' ' LEU . 4.3 t80 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.546 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.508 ' O ' HG23 ' B' ' 104' ' ' VAL . 3.4 mt . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.882 0.372 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.683 ' HA ' HD13 ' A' ' 65' ' ' LEU . 2.1 pt? -52.24 -41.84 63.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.813 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.511 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 20.9 tttt -60.32 -38.84 84.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -34.41 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.722 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 1.077 HG22 ' HB1' ' A' ' 6' ' ' ALA . 2.8 t -70.97 -34.79 56.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.496 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.7 OUTLIER -66.67 -45.62 78.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.961 0.41 . . . . 0.0 110.065 179.195 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -69.87 -34.33 73.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.642 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.625 179.694 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 53.0 mtm-85 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.83 0.348 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -59.3 -36.54 75.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.96 -39.78 78.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.212 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.27 -51.18 56.09 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.085 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 3.3 ttp-105 -65.77 -26.79 67.88 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.303 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -72.6 -48.74 37.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.47 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.808 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -68.86 -42.51 76.96 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.142 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.625 HH21 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -61.26 -42.77 99.19 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.893 178.749 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -56.85 -41.44 77.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.176 0.512 . . . . 0.0 109.674 178.863 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -60.48 -38.05 83.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.018 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 1.012 HG13 HD21 ' A' ' 58' ' ' LEU . 57.5 t -57.68 -50.06 78.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.469 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -57.72 -37.81 74.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.105 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.593 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.6 mt -97.43 8.83 43.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.528 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.634 ' O ' HG22 ' A' ' 17' ' ' ILE . 37.3 mm -148.96 69.13 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-O 121.619 0.723 . . . . 0.0 110.092 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -33.46 69.6 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.921 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.71 175.58 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.965 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -110.25 -29.76 8.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.959 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.53 -52.82 61.95 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.419 ' O ' HD12 ' A' ' 26' ' ' LEU . 6.4 mt-10 -50.84 -34.88 29.69 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 11.2 mttt -72.95 -34.14 66.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.86 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -62.38 -42.65 99.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.041 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.79 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -66.93 -40.93 87.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.281 179.422 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 22' ' ' GLU . 1.9 mt -61.46 -38.22 86.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.642 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 19.9 m-85 -65.48 -43.97 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.3 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.756 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 25' ' ' TYR . 17.0 t -65.1 -50.18 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.905 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.069 HD21 HD11 ' A' ' 62' ' ' ILE . 5.9 mt -63.83 -33.5 75.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.426 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -67.02 -41.6 86.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.66 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.83 -43.55 92.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.411 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 37' ' ' MET . 1.7 t80 -60.79 -38.41 85.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.841 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -74.88 -46.79 33.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.869 0.366 . . . . 0.0 111.323 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -77.73 -54.74 6.0 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.2 -34.71 12.13 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.331 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.496 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.1 mtt 72.74 32.03 1.53 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.808 0.337 . . . . 0.0 110.793 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.474 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -84.37 115.1 22.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.709 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.9 t -77.76 -23.71 14.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.8 -37.15 30.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 38' ' ' ASP . 24.8 t -73.55 -35.86 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.664 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.789 ' HA ' HG13 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -73.96 -38.92 64.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.014 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.775 HG22 ' CE1' ' A' ' 74' ' ' TYR . 75.7 t -69.82 -43.04 80.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.936 0.398 . . . . 0.0 110.521 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.77 -50.01 72.29 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.404 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.741 ' HA ' HD12 ' A' ' 48' ' ' LEU . 75.4 m-20 -62.95 -47.34 83.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.376 . . . . 0.0 110.933 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.786 ' HG ' HG11 ' A' ' 29' ' ' VAL . 20.4 mt -50.8 -42.33 58.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 4.2 mtpt -58.48 -51.73 68.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.48 . . . . 0.0 110.811 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.741 HD12 ' HA ' ' A' ' 45' ' ' ASP . 7.7 mt -53.04 -35.54 59.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.941 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.588 HG13 HG13 ' A' ' 50' ' ' ILE . 14.7 p -100.97 3.21 10.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.36 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.88 HG23 ' O ' ' A' ' 55' ' ' ARG . 54.7 mt -139.09 27.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.131 0.491 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -85.54 16.09 4.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.812 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -127.58 140.97 39.51 Favored Pre-proline 0 CA--C 1.523 -0.059 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.59 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HA ' HD12 ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.33 -38.88 15.78 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.378 2.052 . . . . 0.0 111.881 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 t -69.32 -34.76 75.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.716 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.88 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -89.72 -13.88 35.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.775 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.64 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 12.8 mt -49.0 -51.62 54.09 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.64 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 5.1 Cg_exo -39.97 -28.33 0.25 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.242 2.628 . . . . 0.0 113.893 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.012 HD21 HG13 ' A' ' 13' ' ' VAL . 9.3 mt -63.48 -38.58 91.7 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.644 0.259 . . . . 0.0 111.102 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.481 ' CE1' ' CZ ' ' A' ' 74' ' ' TYR . 0.2 OUTLIER -59.82 -44.0 94.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 0.0 110.674 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -75.1 -31.58 61.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.692 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.808 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.82 -60.25 3.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.391 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 1.069 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -66.93 -30.01 48.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.829 -179.645 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.474 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 16.1 ttp180 -40.21 -58.08 2.52 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.2 Cg_endo -48.48 -30.0 14.92 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.706 2.271 . . . . 0.0 113.125 -178.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.568 HD12 ' CG1' ' A' ' 62' ' ' ILE . 12.9 mt -65.37 -49.61 68.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.482 0.658 . . . . 0.0 109.872 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.484 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -47.12 133.73 9.08 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.159 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.33 165.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.488 2.125 . . . . 0.0 112.14 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.6 tp -56.46 -57.79 10.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.871 0.367 . . . . 0.0 110.928 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.7 pttt -58.97 -48.93 79.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.081 0.467 . . . . 0.0 110.429 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.484 ' CB ' HG23 ' A' ' 66' ' ' ILE . 38.3 m170 -60.73 -29.21 69.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.386 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.66 -42.3 91.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.059 0.457 . . . . 0.0 110.241 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 31.1 t -62.45 -45.35 98.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.362 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.33 -31.88 69.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.458 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.775 ' CE1' HG22 ' A' ' 43' ' ' VAL . 63.2 t80 . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.731 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.483 ' HB3' HD22 ' A' ' 65' ' ' LEU . 30.9 mt . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.673 0.273 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 101' ' ' LEU . . . . . 0.538 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.6 OUTLIER -51.76 -53.2 42.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.855 -179.842 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 pttt -61.2 -31.7 71.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.72 -40.39 94.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.945 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 104' ' ' VAL . . . . . 0.773 HG11 ' CZ ' ' A' ' 9' ' ' PHE . 2.4 t -71.16 -46.5 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.458 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 105' ' ' LEU . . . . . 0.624 HD21 ' HB3' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -65.08 -45.5 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.957 0.408 . . . . 0.0 110.478 179.845 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -66.03 -37.83 86.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.075 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 . . . . . 0 C--N 1.327 -0.411 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.34 -179.775 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 ptp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.868 0.366 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.528 ' HB3' HD21 ' B' ' 100' ' ' LEU . 1.1 t70 -130.71 34.4 4.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.88 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tpp85 -82.48 -34.17 28.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.973 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.03 -33.73 73.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.854 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.7 t -64.24 -35.58 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.076 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.71 -51.0 38.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.995 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.31 -26.84 68.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.229 179.313 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -70.76 -47.69 58.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.475 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.728 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.58 -44.53 67.18 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.761 ' CZ ' HD22 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -55.93 -43.87 77.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.736 178.417 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.412 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 9.6 m170 -60.13 -41.14 92.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.085 0.469 . . . . 0.0 109.952 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -61.22 -37.55 83.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.129 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.861 HG22 ' CD2' ' A' ' 58' ' ' LEU . 47.0 t -59.97 -49.13 85.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.392 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.66 -37.54 73.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.178 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -68.84 -37.12 78.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.699 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 mt -97.72 8.96 43.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.535 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.646 ' O ' HG22 ' A' ' 17' ' ' ILE . 36.7 mm -149.76 69.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-O 121.731 0.777 . . . . 0.0 110.112 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.803 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.83 160.72 16.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.724 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.73 -29.42 14.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.969 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.98 -53.64 54.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.517 ' HB2' HG23 ' A' ' 17' ' ' ILE . 11.0 mt-10 -50.91 -34.84 30.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.412 ' O ' ' CG ' ' A' ' 27' ' ' TYR . 8.2 mttm -73.52 -34.78 65.4 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.905 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -65.42 -43.8 89.36 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.15 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.897 ' O ' HG23 ' A' ' 29' ' ' VAL . 5.7 t80 -64.37 -41.3 96.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.205 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.37 -39.85 95.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.359 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.412 ' CG ' ' O ' ' A' ' 23' ' ' LYS . 20.6 m-85 -60.29 -43.8 95.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.495 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -64.66 -34.43 78.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.498 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 25' ' ' TYR . 17.5 t -67.82 -43.41 86.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.783 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.037 HD21 HD11 ' A' ' 62' ' ' ILE . 16.1 mt -66.12 -42.51 89.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.628 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -32.93 74.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.624 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.415 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 70.9 mmm -66.66 -47.06 73.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.583 ' CG ' HD12 ' A' ' 42' ' ' LEU . 13.3 t80 -59.37 -40.83 87.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.038 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -67.86 -43.39 79.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.346 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.507 ' HG3' HG23 ' A' ' 36' ' ' THR . 19.4 pt20 -77.24 -50.0 13.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.901 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.507 HG23 ' HG3' ' A' ' 35' ' ' GLN . 22.3 p -78.08 -30.5 49.64 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.425 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.2 mmt 62.64 28.73 16.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.952 0.406 . . . . 0.0 110.718 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -119.53 122.31 41.35 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.88 ' O ' HG23 ' A' ' 43' ' ' VAL . 14.9 t -78.66 -7.27 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.537 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.0 -36.99 58.96 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.091 0.472 . . . . 0.0 110.22 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.95 -34.03 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.959 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.819 HD23 HG12 ' A' ' 29' ' ' VAL . 1.3 mt -65.52 -46.34 80.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.844 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 39' ' ' VAL . 33.4 t -57.54 -45.73 86.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.423 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.91 -58.0 15.91 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.772 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -64.67 -36.35 83.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.089 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.587 HD13 ' OH ' ' A' ' 74' ' ' TYR . 13.8 mt -52.89 -55.02 26.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.831 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -54.48 -43.35 71.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.767 179.685 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.98 -45.78 61.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.788 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 49' ' ' VAL . 13.4 p -100.98 8.42 8.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.342 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.766 HG22 ' O ' ' A' ' 50' ' ' ILE . 60.1 mt -138.51 27.11 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.33 0.586 . . . . 0.0 111.034 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.46 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -85.78 15.91 4.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.803 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -127.65 144.27 50.53 Favored Pre-proline 0 C--O 1.23 0.072 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.427 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.514 ' HA ' HD12 ' A' ' 56' ' ' LEU . 6.5 Cg_endo -48.7 -37.97 36.06 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.347 2.032 . . . . 0.0 111.513 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -69.38 -34.07 74.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.644 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.763 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -90.46 -12.45 37.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.79 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 53' ' ' PRO . 13.8 mt -52.51 -45.86 95.5 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.9 Cg_exo -47.01 -23.92 2.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.735 2.29 . . . . 0.0 113.595 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.861 ' CD2' HG22 ' A' ' 13' ' ' VAL . 12.4 mt -73.73 -37.63 65.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.736 0.303 . . . . 0.0 111.322 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.664 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -60.06 -48.83 80.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.908 0.385 . . . . 0.0 111.111 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.402 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -75.22 -30.99 60.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.994 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.728 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -63.73 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.283 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 1.037 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -59.93 -34.24 55.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -41.53 -63.12 0.89 Allowed Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.905 -178.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 87.0 Cg_exo -33.8 -33.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.338 2.692 . . . . 0.0 113.541 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.476 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.5 mt -64.91 -53.81 40.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.355 0.598 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.574 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -43.41 132.19 3.59 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.116 179.52 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.86 165.5 10.02 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.618 2.212 . . . . 0.0 112.019 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.442 ' O ' HG23 ' A' ' 72' ' ' VAL . 2.1 tt -51.99 -51.36 57.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.219 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -61.06 2.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 0.0 110.539 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.607 ' HB3' HG21 ' A' ' 39' ' ' VAL . 36.8 m170 -59.21 -23.66 62.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -43.43 86.94 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.116 0.484 . . . . 0.0 110.166 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 68' ' ' LEU . 27.2 t -64.85 -45.51 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.374 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -32.98 70.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.473 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.912 ' O ' HG23 ' A' ' 78' ' ' THR . 7.5 t80 -69.87 -46.8 64.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.539 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -61.93 -37.47 84.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.628 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -63.83 -45.24 90.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.704 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.3 mt -65.07 -34.84 79.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.912 HG23 ' O ' ' A' ' 74' ' ' TYR . 14.0 p -77.18 154.17 82.36 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.002 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.51 74.24 1.19 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.717 2.278 . . . . 0.0 112.305 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.8 ttm-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.885 179.989 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.278 0 N-CA-C 112.774 -0.13 . . . . 0.0 112.774 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 56.29 83.56 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.738 0.304 . . . . 0.0 111.12 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.528 HD21 ' HB3' ' A' ' 2' ' ' ASP . 10.6 mt -72.4 -40.84 66.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.027 0.442 . . . . 0.0 110.83 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.62 HD11 HD23 ' A' ' 30' ' ' LEU . 9.5 tp -55.32 -52.66 62.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.597 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.42 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.5 OUTLIER -56.75 -33.41 66.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.05 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.076 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.9 t -68.69 -36.53 74.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.257 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.471 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.8 OUTLIER -63.5 -45.62 89.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 110.294 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.7 -35.8 81.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.623 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -60.68 -41.4 95.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.455 ' CE2' ' CG ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -68.11 -53.52 24.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.714 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 16.8 mt -51.17 -37.15 44.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.888 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -76.89 -36.67 56.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.383 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.761 HD22 ' CZ ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -68.63 -12.36 61.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.268 178.954 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 30.7 mmtt -78.91 -76.84 0.19 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.936 0.398 . . . . 0.0 110.793 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.938 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.71 0.29 . . . . 0.0 111.255 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.785 ' HB2' HG23 ' A' ' 5' ' ' VAL . 4.0 m-20 -150.21 164.19 36.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.901 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -41.04 42.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.909 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.45 -33.55 73.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.825 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.785 HG23 ' HB2' ' A' ' 2' ' ' ASP . 62.0 t -61.42 -36.86 75.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.207 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.99 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.04 -51.16 41.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.105 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 -67.17 -26.84 66.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.156 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -72.7 -45.99 55.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.289 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.691 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.76 -43.92 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.516 ' NH2' HD22 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -57.37 -44.92 84.82 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.768 178.453 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -58.91 -39.31 81.13 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.202 0.525 . . . . 0.0 109.743 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -62.47 -38.1 88.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.282 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.69 HG22 HD22 ' A' ' 58' ' ' LEU . 52.9 t -59.6 -48.21 88.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.512 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -57.59 -42.64 83.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.17 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -69.01 -33.56 73.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.617 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.43 ' O ' HD13 ' A' ' 17' ' ' ILE . 69.5 mt -95.4 6.44 49.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.651 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.645 ' O ' HG22 ' A' ' 17' ' ' ILE . 40.3 mm -147.12 68.35 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-O 121.657 0.741 . . . . 0.0 110.037 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.15 -35.75 67.51 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.921 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -63.46 174.89 1.14 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -109.3 -30.51 7.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.41 -51.88 66.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.487 ' OE1' HG23 ' A' ' 17' ' ' ILE . 12.6 mt-10 -50.88 -34.8 29.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.39 0.614 . . . . 0.0 109.42 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -72.4 -33.67 67.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.26 -43.08 95.97 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.147 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.87 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.3 t80 -64.56 -43.22 94.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.233 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.4 tp -59.09 -41.13 87.33 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.54 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -60.0 -47.92 83.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.76 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -59.09 -39.32 81.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.735 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 25' ' ' TYR . 5.1 t -63.87 -49.65 80.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.929 HD21 HD11 ' A' ' 62' ' ' ILE . 5.4 mt -62.17 -40.71 96.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.365 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -60.27 -34.53 73.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.398 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.63 ' SD ' HG11 ' A' ' 41' ' ' VAL . 4.2 mmt -66.08 -51.41 58.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.242 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.49 ' CG ' HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -53.53 -35.53 60.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.085 0.469 . . . . 0.0 110.543 179.419 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -55.64 5.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.84 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.69 -55.24 5.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.425 ' HG1' ' C ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -82.74 -36.17 25.99 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.603 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.461 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.3 mmt 64.77 23.93 12.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.02 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.596 ' OD2' HG23 ' A' ' 41' ' ' VAL . 29.4 t70 -100.59 114.74 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.333 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.895 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.5 t -73.01 -8.62 11.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.583 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.51 ' HB3' ' OD2' ' A' ' 38' ' ' ASP . . . -75.57 -34.26 60.67 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.072 0.463 . . . . 0.0 110.243 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.63 HG11 ' SD ' ' A' ' 32' ' ' MET . 29.0 t -73.62 -33.85 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.417 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.818 HD23 HG12 ' A' ' 29' ' ' VAL . 0.5 OUTLIER -69.18 -42.63 75.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.831 179.901 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 39' ' ' VAL . 46.7 t -58.06 -43.29 84.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.091 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.84 -56.17 15.95 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.78 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.463 ' CB ' HG22 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -63.08 -49.12 75.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.839 0.352 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HG ' HG11 ' A' ' 29' ' ' VAL . 68.5 mt -50.57 -48.0 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.086 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.77 -49.57 72.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.075 0.464 . . . . 0.0 110.634 179.776 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.429 HD13 ' OH ' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -51.85 -39.65 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.023 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 49' ' ' VAL . 12.4 p -101.46 7.28 9.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.445 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.798 HG23 ' O ' ' A' ' 55' ' ' ARG . 77.9 mt -143.15 28.06 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.257 0.551 . . . . 0.0 111.419 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.447 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.4 p30 -89.81 14.99 10.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.641 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -130.94 150.47 76.68 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.575 0.226 . . . . 0.0 110.607 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.504 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.5 Cg_endo -52.1 -38.6 70.78 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.402 2.068 . . . . 0.0 111.447 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.32 -33.23 72.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.367 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.798 ' O ' HG23 ' A' ' 50' ' ' ILE . 11.1 mtt85 -91.75 -5.88 52.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.573 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.6 mt -60.56 -44.8 96.58 Favored Pre-proline 0 CA--C 1.53 0.206 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.68 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 90.4 Cg_exo -43.48 -28.11 1.57 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.705 2.27 . . . . 0.0 113.421 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.69 HD22 HG22 ' A' ' 13' ' ' VAL . 16.0 mt -73.85 -33.91 64.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.902 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.757 ' CE2' HG22 ' A' ' 78' ' ' THR . 0.1 OUTLIER -61.28 -48.65 80.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.734 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.409 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.1 t0 -75.22 -31.0 60.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.651 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.691 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.71 -62.89 1.53 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.738 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.929 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.81 -31.78 53.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.724 -179.585 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.505 ' HA ' HD12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -37.15 -66.69 0.27 Allowed Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 112.327 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 76.8 Cg_exo -36.6 -32.39 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.092 2.528 . . . . 0.0 113.561 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.583 HD12 ' CG1' ' A' ' 62' ' ' ILE . 19.2 mt -65.67 -51.09 62.16 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.718 0.771 . . . . 0.0 109.439 179.32 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.505 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.9 mt -44.26 121.87 4.08 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.373 -1.285 . . . . 0.0 111.53 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.4 ' O ' ' N ' ' A' ' 71' ' ' GLN . 76.1 Cg_exo -47.84 165.75 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.832 2.355 . . . . 0.0 112.439 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.3 tt -55.51 -56.9 14.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.785 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -44.47 97.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.43 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 23.5 m170 -63.9 -29.3 70.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.288 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.418 ' HA ' HG21 ' A' ' 66' ' ' ILE . 1.4 mt-30 -61.51 -42.08 98.27 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.172 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.89 -46.26 89.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.09 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -65.01 -33.07 75.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.213 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.704 ' O ' HG23 ' A' ' 78' ' ' THR . 59.3 t80 -62.61 -46.62 87.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.512 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.418 ' O ' ' OG1' ' A' ' 78' ' ' THR . 6.9 t0 -66.32 -32.96 74.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.752 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -66.76 -35.37 79.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.107 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.577 ' HB2' HG21 ' A' ' 43' ' ' VAL . 28.4 mt -93.09 -24.09 18.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.039 -179.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.757 HG22 ' CE2' ' A' ' 59' ' ' PHE . 2.2 p -46.51 -50.36 41.21 Favored Pre-proline 0 CA--C 1.533 0.3 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 78' ' ' THR . 22.2 Cg_endo -60.78 175.71 1.16 Allowed 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.112 1.875 . . . . 0.0 112.351 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.022 -179.929 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 29.9 t -157.87 99.43 1.69 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.846 0.355 . . . . 0.0 110.922 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.419 ' O ' HG23 ' B' ' 104' ' ' VAL . 3.9 mt -77.31 -35.55 54.84 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.852 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 13.2 tp -54.45 -52.8 60.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.854 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 45.5 tttm -57.45 -31.52 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.835 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.98 -36.79 80.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.877 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.99 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.4 t -71.04 -37.19 66.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.475 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.8 OUTLIER -65.0 -45.57 85.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.006 0.431 . . . . 0.0 110.291 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -68.92 -34.63 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -60.88 -41.08 95.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -46.92 62.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.635 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 50.2 mt -51.18 -38.24 51.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.646 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 11.4 mtt-85 -76.91 -37.27 55.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.247 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.516 HD22 ' NH2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -62.94 -16.83 60.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.104 178.865 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -86.86 -48.49 8.15 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.815 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.861 179.996 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.744 0.307 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.403 ' HB3' HD21 ' B' ' 100' ' ' LEU . 1.4 t70 59.88 31.51 20.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.907 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.67 -32.05 7.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.991 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.07 -40.3 89.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.947 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.7 t -60.45 -35.02 60.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.003 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.049 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.27 -50.95 42.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.182 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -26.77 67.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -71.22 -48.98 48.11 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.688 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -70.04 -43.02 72.13 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.919 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.478 ' NE ' HD13 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -56.87 -44.11 81.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.716 178.487 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.49 -42.68 88.13 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.2 -35.43 75.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.29 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.68 HG13 HD22 ' A' ' 58' ' ' LEU . 43.3 t -62.22 -49.03 85.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.616 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.63 -37.74 73.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.198 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -68.95 -30.11 68.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.456 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.404 ' O ' HD13 ' A' ' 17' ' ' ILE . 5.2 mt -105.35 10.18 33.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.611 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.74 HG23 ' HB2' ' A' ' 22' ' ' GLU . 37.3 mm -146.26 67.96 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 CA-C-O 121.679 0.752 . . . . 0.0 110.151 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -79.12 -26.18 42.9 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.023 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.2 OUTLIER -49.2 -25.14 2.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.551 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 19' ' ' ASN . 5.8 t0 82.76 -53.14 0.19 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.097 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.57 -50.06 68.89 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.74 ' HB2' HG23 ' A' ' 17' ' ' ILE . 21.9 mt-10 -50.86 -34.59 28.67 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.456 ' HD3' ' CE1' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -69.23 -35.7 76.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.953 178.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.423 ' HA ' ' CD2' ' A' ' 27' ' ' TYR . 1.0 OUTLIER -62.23 -47.37 84.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.014 0.435 . . . . 0.0 110.187 179.467 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.906 ' O ' HG23 ' A' ' 29' ' ' VAL . 3.6 t80 -61.41 -39.33 90.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.328 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.636 HD22 HG11 ' A' ' 13' ' ' VAL . 0.2 OUTLIER -60.3 -40.99 92.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.497 179.583 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.423 ' CD2' ' HA ' ' A' ' 24' ' ' ASP . 11.6 m-85 -60.87 -46.82 89.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.408 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.43 -37.03 82.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.766 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 1.062 HG12 HD13 ' A' ' 42' ' ' LEU . 21.8 t -63.29 -44.64 99.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.807 HD21 HD11 ' A' ' 62' ' ' ILE . 7.0 mt -64.77 -46.41 82.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.509 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -32.33 72.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.46 ' HG2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -68.23 -45.72 72.48 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.454 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.652 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.3 t80 -59.47 -38.37 80.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.963 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -74.52 -44.9 49.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.826 0.346 . . . . 0.0 111.544 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -55.09 5.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 112.059 -179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 p -74.71 -40.24 61.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.434 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.2 mtp 69.96 26.04 4.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.89 0.376 . . . . 0.0 110.7 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.46 124.66 53.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.645 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.889 ' O ' HG23 ' A' ' 43' ' ' VAL . 29.6 t -77.33 -10.36 13.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.207 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.72 -35.41 44.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.964 0.411 . . . . 0.0 110.61 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.46 HG11 ' HG2' ' A' ' 32' ' ' MET . 32.8 t -71.11 -34.3 54.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.236 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.062 HD13 HG12 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -70.0 -47.99 59.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.002 179.78 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 39' ' ' VAL . 46.9 t -57.44 -40.41 74.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.788 0.328 . . . . 0.0 111.039 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.93 -56.25 17.42 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.698 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.503 ' HB3' HG22 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.43 -48.61 77.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.838 0.351 . . . . 0.0 111.13 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.56 -46.93 57.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.147 -179.707 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.3 -52.33 64.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.792 179.81 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.92 -38.6 36.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.958 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.626 HG21 HD12 ' A' ' 26' ' ' LEU . 14.7 p -101.2 4.6 10.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.594 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.901 HG23 ' O ' ' A' ' 55' ' ' ARG . 58.2 mt -138.46 27.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 121.267 0.555 . . . . 0.0 111.161 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.435 ' N ' ' O ' ' A' ' 47' ' ' LYS . 34.3 m-20 -85.49 12.81 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.748 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.75 142.82 43.23 Favored Pre-proline 0 C--N 1.334 -0.071 0 O-C-N 122.3 -0.25 . . . . 0.0 110.674 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.441 ' HA ' HD12 ' A' ' 56' ' ' LEU . 88.5 Cg_exo -46.27 -38.87 20.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.288 1.992 . . . . 0.0 111.788 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -33.62 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.588 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.901 ' O ' HG23 ' A' ' 50' ' ' ILE . 40.8 mtt180 -90.75 -11.43 39.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.727 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.497 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -54.31 -45.35 99.28 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 88.0 Cg_exo -45.87 -24.76 2.28 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.853 2.369 . . . . 0.0 113.667 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.68 HD22 HG13 ' A' ' 13' ' ' VAL . 9.3 mt -72.92 -35.83 67.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.698 0.285 . . . . 0.0 110.919 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.665 ' HE2' HG22 ' A' ' 78' ' ' THR . 0.3 OUTLIER -58.01 -50.79 72.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.751 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.422 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 2.8 t0 -75.38 -31.26 60.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.809 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.469 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.9 -56.25 23.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.849 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.807 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -67.17 -32.54 58.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 111.559 -179.548 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.5 mtp180 -37.37 -63.72 0.47 Allowed Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.473 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.439 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 74.9 Cg_exo -36.9 -32.64 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.127 2.552 . . . . 0.0 113.617 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.532 HD11 ' CE2' ' A' ' 9' ' ' PHE . 14.1 mt -65.53 -50.75 64.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.624 0.726 . . . . 0.0 109.79 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.465 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -46.62 133.07 8.14 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.242 179.754 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -49.6 165.6 0.26 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.64 2.226 . . . . 0.0 112.284 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -57.87 10.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.855 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -50.02 75.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.039 0.447 . . . . 0.0 110.303 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.441 ' CB ' HG23 ' A' ' 66' ' ' ILE . 53.0 m170 -60.7 -27.59 68.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.374 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -65.35 -44.21 88.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.9 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 19.9 t -61.45 -43.54 96.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.326 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -66.51 -47.06 74.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.383 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.911 ' O ' HG23 ' A' ' 78' ' ' THR . 35.7 t80 -60.44 -37.44 80.92 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.443 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.496 ' O ' ' HD3' ' A' ' 79' ' ' PRO . 0.6 OUTLIER -65.76 -44.06 87.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.587 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -67.0 -24.61 66.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.551 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 mt -90.52 -26.0 19.98 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.911 HG23 ' O ' ' A' ' 74' ' ' TYR . 75.4 p -50.82 -37.65 35.18 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 78' ' ' THR . 1.9 Cg_endo -82.31 -175.16 2.38 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.687 2.258 . . . . 0.0 112.316 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 16.9 ptt-85 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.732 179.908 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 N-CA-C 112.551 -0.219 . . . . 0.0 112.551 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 74.3 p -147.7 113.01 5.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.824 0.345 . . . . 0.0 110.839 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.424 ' HB3' HD22 ' A' ' 65' ' ' LEU . 49.6 mt -114.2 -31.62 6.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.032 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.505 HD23 ' H ' ' B' ' 101' ' ' LEU . 0.4 OUTLIER -54.03 -35.18 61.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.128 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.535 ' HA ' HD21 ' B' ' 105' ' ' LEU . 0.0 OUTLIER -68.6 -33.19 73.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.95 -38.23 76.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.049 HG22 ' HB1' ' A' ' 6' ' ' ALA . 39.0 t -71.01 -51.0 38.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.371 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.566 HD12 ' N ' ' B' ' 106' ' ' GLU . 3.8 pp -61.57 -33.48 73.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.573 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' GLU . . . . . 0.566 ' N ' HD12 ' B' ' 105' ' ' LEU . 6.6 tt0 -73.79 -38.77 64.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 0.0 110.257 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -67.23 -29.18 68.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.591 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.477 ' CD2' ' HG3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.81 -56.57 4.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.013 0.435 . . . . 0.0 110.99 -179.953 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.841 HD12 ' N ' ' B' ' 110' ' ' ARG . 4.0 pp -52.91 -39.46 62.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.67 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' ARG . . . . . 0.841 ' N ' HD12 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -77.03 -34.72 57.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.579 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.478 HD13 ' NE ' ' A' ' 10' ' ' ARG . 5.9 mt -64.89 -17.11 64.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.177 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 112' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' B' ' 108' ' ' TYR . 28.9 mmmt -99.18 -40.56 7.91 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.679 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.888 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.433 0 CA-C-O 120.756 0.312 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.2 p-10 -141.61 -46.42 0.37 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.007 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.78 -34.83 18.17 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.948 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.95 -33.68 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.829 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.43 -35.92 74.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.018 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -70.22 -50.89 35.27 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.964 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -26.81 68.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.155 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -70.97 -48.98 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.357 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.77 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.04 -43.59 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.084 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.745 ' HD2' HG12 ' B' ' 104' ' ' VAL . 2.5 tpm_? -57.1 -44.94 83.7 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.712 178.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.83 -40.04 79.1 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.792 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.7 mtpt -62.82 -36.8 84.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.029 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.902 HG22 HD22 ' A' ' 58' ' ' LEU . 46.5 t -58.59 -48.99 84.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.285 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -57.58 -42.25 82.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.081 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -69.1 -34.62 75.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.523 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.433 ' O ' HD13 ' A' ' 17' ' ' ILE . 78.3 mt -95.12 7.34 46.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.595 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.64 ' O ' HG22 ' A' ' 17' ' ' ILE . 40.0 mm -148.27 68.69 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.73 0.776 . . . . 0.0 110.129 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -57.16 -36.13 70.38 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.97 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -64.55 169.18 5.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.695 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -102.54 -31.46 10.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.95 67.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.933 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.623 ' O ' HD12 ' A' ' 26' ' ' LEU . 22.5 mt-10 -50.77 -34.69 28.29 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 27.7 mttt -72.71 -35.19 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.939 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -62.86 -41.11 99.24 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.132 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.804 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -65.92 -45.75 80.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.298 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.623 HD12 ' O ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -60.36 -39.56 87.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.703 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.0 m-85 -61.82 -44.06 97.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.701 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -65.56 -40.98 93.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.648 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.804 HG23 ' O ' ' A' ' 25' ' ' TYR . 46.4 t -60.82 -53.25 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.063 0.459 . . . . 0.0 110.982 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.007 HD21 HD11 ' A' ' 62' ' ' ILE . 4.0 mt -59.98 -36.19 76.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.657 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.43 ' NH2' HD11 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -66.77 -43.14 84.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.569 179.796 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -45.06 94.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.046 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.675 ' CE1' HG22 ' A' ' 39' ' ' VAL . 6.6 t80 -57.65 -48.17 80.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.781 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.576 ' CE1' ' HB2' ' B' ' 102' ' ' LYS . 5.2 t60 -74.99 -33.66 61.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.873 0.368 . . . . 0.0 111.664 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -77.44 -54.98 5.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.7 p -93.98 -6.0 46.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.475 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.5 mmt 58.87 23.5 11.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.708 0.29 . . . . 0.0 110.96 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.419 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.5 t0 -98.22 116.72 31.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.915 0.388 . . . . 0.0 110.912 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.845 ' O ' HG23 ' A' ' 43' ' ' VAL . 27.8 t -82.52 -20.7 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.27 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.64 -28.1 55.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.804 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 38' ' ' ASP . 48.0 t -73.46 -43.77 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.782 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.5 pp -68.53 -39.21 81.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.753 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.845 HG23 ' O ' ' A' ' 39' ' ' VAL . 84.9 t -60.65 -40.71 85.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.853 0.358 . . . . 0.0 110.389 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.51 -59.13 9.23 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.26 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.474 ' CB ' HG22 ' A' ' 29' ' ' VAL . 12.4 m-20 -60.1 -44.2 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 110.771 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.773 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.7 mt -51.3 -44.13 61.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.73 -48.31 78.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.105 0.479 . . . . 0.0 110.627 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 mt -54.17 -37.53 64.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.824 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 49' ' ' VAL . 11.9 p -101.04 5.13 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.428 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.879 HG23 ' O ' ' A' ' 55' ' ' ARG . 65.7 mt -142.33 29.08 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-O 121.301 0.572 . . . . 0.0 110.72 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.7 p-10 -88.07 15.2 7.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.945 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.2 pt-20 -131.69 149.12 72.54 Favored Pre-proline 0 C--N 1.334 -0.098 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.765 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.603 ' HA ' HD12 ' A' ' 56' ' ' LEU . 7.2 Cg_endo -49.51 -38.51 44.47 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.697 2.265 . . . . 0.0 111.812 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.2 t -69.12 -33.93 74.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.609 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.879 ' O ' HG23 ' A' ' 50' ' ' ILE . 97.9 mtt180 -94.5 -5.28 46.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.685 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.603 HD12 ' HA ' ' A' ' 53' ' ' PRO . 12.2 mt -59.44 -45.24 98.91 Favored Pre-proline 0 CA--C 1.532 0.284 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 81.4 Cg_exo -42.94 -29.03 1.38 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.772 2.315 . . . . 0.0 113.475 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.902 HD22 HG22 ' A' ' 13' ' ' VAL . 14.4 mt -73.94 -32.29 63.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.741 0.305 . . . . 0.0 111.023 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.469 ' CD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -60.83 -50.02 75.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.095 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.407 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 22.5 t0 -75.21 -31.02 60.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.894 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.739 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.73 -60.26 4.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.95 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 1.007 HD11 HD21 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -59.3 -36.99 66.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.928 -179.534 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.475 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -36.32 -66.8 0.25 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.479 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.478 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 79.7 Cg_exo -36.14 -33.04 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.191 2.594 . . . . 0.0 113.342 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.657 HD11 ' CE2' ' A' ' 9' ' ' PHE . 22.7 mt -65.07 -51.93 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.0 109.875 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.427 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -47.22 136.73 8.74 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.032 179.622 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.25 165.61 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.483 2.122 . . . . 0.0 112.34 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 tp -57.09 -57.87 10.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.955 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -51.41 69.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.106 0.479 . . . . 0.0 110.345 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.427 ' CB ' HG23 ' A' ' 66' ' ' ILE . 31.5 m170 -59.91 -28.31 67.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.325 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.32 -44.31 95.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.086 0.469 . . . . 0.0 110.155 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.32 -47.35 93.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.345 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.45 -39.38 93.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.356 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.892 ' O ' HG23 ' A' ' 78' ' ' THR . 57.6 t80 -63.51 -42.69 98.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.691 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -45.5 91.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.704 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -59.97 -39.46 85.72 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.672 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 74' ' ' TYR . 9.0 mt -70.58 -30.09 66.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.861 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.892 HG23 ' O ' ' A' ' 74' ' ' TYR . 16.0 p -87.89 149.51 45.87 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.784 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -73.82 103.53 1.67 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.466 2.111 . . . . 0.0 112.346 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.922 179.983 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.554 -0.219 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 69.5 p -147.56 98.7 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.842 0.353 . . . . 0.0 110.856 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.656 ' O ' HG23 ' B' ' 104' ' ' VAL . 6.0 mt -82.68 -55.03 4.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.952 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.812 HD11 HD23 ' A' ' 30' ' ' LEU . 13.9 tp -55.1 -52.86 61.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.093 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.576 ' HB2' ' CE1' ' A' ' 34' ' ' HIS . 0.6 OUTLIER -55.6 -37.57 68.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.92 -36.54 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.719 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.018 HG22 ' HB1' ' A' ' 6' ' ' ALA . 2.1 t -71.09 -34.09 53.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.078 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -70.87 -45.72 63.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.973 0.416 . . . . 0.0 110.365 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.0 -39.74 87.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.903 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -59.65 -50.41 73.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.753 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.436 ' CD1' ' HG2' ' A' ' 10' ' ' ARG . 1.4 t80 -71.8 -43.88 64.9 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.811 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.43 HD11 ' NH2' ' A' ' 31' ' ' ARG . 13.2 mt -51.11 -40.78 59.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.662 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -76.89 -35.09 57.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.058 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -16.47 61.2 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.389 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 3.9 mmmt -81.44 -51.05 8.72 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.825 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.4 pttt . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.374 179.915 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.786 0.327 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -132.54 -179.95 5.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.89 -33.14 74.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.915 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -65.58 -36.81 84.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.753 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.2 -35.13 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.912 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.006 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.63 -51.15 53.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.271 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.427 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -64.41 -26.95 68.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.245 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.8 -49.08 50.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.553 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -68.83 -43.29 75.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HG3' ' CG1' ' B' ' 104' ' ' VAL . 0.7 OUTLIER -61.96 -40.23 94.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.881 178.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.427 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 8.2 m170 -56.99 -41.37 78.28 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -60.96 -36.11 78.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.795 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.627 HG13 HD22 ' A' ' 58' ' ' LEU . 50.1 t -58.82 -48.7 85.38 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.105 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.17 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.7 -39.22 76.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.119 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -68.78 -31.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.465 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.3 mt -102.29 8.94 40.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.44 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.699 ' O ' HG22 ' A' ' 17' ' ' ILE . 31.3 mm -149.97 69.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 CA-C-O 121.677 0.751 . . . . 0.0 110.025 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -58.96 -33.84 71.11 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.899 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -63.46 160.8 15.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.801 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -97.64 -30.76 12.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.978 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.15 -52.95 61.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.007 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -50.95 -34.78 30.22 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.2 mttt -72.82 -34.3 66.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.766 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -61.77 -43.03 99.65 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -65.55 -45.54 83.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.289 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.7 tt -60.81 -40.81 94.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.455 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.419 ' OH ' ' CE2' ' B' ' 108' ' ' TYR . 14.1 m-85 -59.26 -43.42 92.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -69.54 -37.34 77.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.813 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 25' ' ' TYR . 40.7 t -62.36 -52.33 61.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.876 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.017 HD21 HD11 ' A' ' 62' ' ' ILE . 41.2 mt -60.9 -41.12 95.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.667 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -40.22 87.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.268 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -45.62 87.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.971 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.561 ' CG ' HD22 ' A' ' 42' ' ' LEU . 4.9 t80 -55.58 -44.67 77.1 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.941 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -74.87 -34.42 62.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.556 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.47 -55.06 5.7 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.0 p -88.07 -14.62 38.43 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.447 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.8 mmt 61.37 23.6 13.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.739 0.304 . . . . 0.0 110.626 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -98.48 116.72 31.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.744 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.762 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.4 t -81.27 -20.77 10.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.281 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.09 -29.27 48.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.339 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.2 t -73.42 -42.88 56.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.79 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.749 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.1 pp -70.2 -39.73 75.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.744 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.762 HG23 ' O ' ' A' ' 39' ' ' VAL . 81.6 t -65.01 -37.36 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.938 0.399 . . . . 0.0 110.388 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.34 -56.68 18.59 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.137 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -64.72 -44.69 89.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.857 0.36 . . . . 0.0 110.774 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.874 ' HG ' HG11 ' A' ' 29' ' ' VAL . 13.7 mt -50.97 -41.07 59.15 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.688 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.48 -46.62 89.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.398 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.68 -34.49 65.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.563 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 49' ' ' VAL . 9.4 p -100.92 0.3 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.3 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.902 HG23 ' O ' ' A' ' 55' ' ' ARG . 50.8 mt -138.5 29.31 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.334 0.587 . . . . 0.0 110.939 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.483 ' N ' ' O ' ' A' ' 47' ' ' LYS . 20.7 p30 -87.53 16.77 5.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.787 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.7 mm-40 -127.35 143.57 47.7 Favored Pre-proline 0 C--N 1.334 -0.091 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.443 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.427 ' HA ' HD12 ' A' ' 56' ' ' LEU . 5.6 Cg_endo -47.83 -38.47 30.37 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.452 2.101 . . . . 0.0 111.518 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.33 -33.8 73.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.713 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.902 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.8 mtt180 -92.04 -10.32 39.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.885 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.493 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.9 mt -55.62 -44.7 99.79 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.733 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.3 Cg_exo -44.31 -26.77 1.73 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.661 2.24 . . . . 0.0 113.474 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.699 HD12 HG12 ' A' ' 50' ' ' ILE . 3.7 mt -73.69 -32.0 63.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.842 0.353 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.504 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -67.54 -40.78 85.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.81 179.864 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 18.2 t70 -75.37 -31.0 60.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.811 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.63 -56.84 6.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.864 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 1.017 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -61.27 -38.16 79.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.86 -179.239 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.444 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -39.69 -65.14 0.45 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.258 -179.002 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 70.6 Cg_exo -35.59 -32.91 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.261 2.641 . . . . 0.0 113.483 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.6 mt -65.07 -53.72 41.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 109.822 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.557 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.5 mp -42.26 128.15 2.8 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.306 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.79 165.69 1.09 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.791 2.328 . . . . 0.0 112.347 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -52.47 -53.6 43.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.031 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.539 ' O ' HG12 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -57.51 -54.65 44.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.682 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.557 ' CB ' HG23 ' A' ' 66' ' ' ILE . 27.2 m170 -63.11 -20.44 65.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.555 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -53.91 32.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.967 0.413 . . . . 0.0 110.244 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 69' ' ' LYS . 6.1 p -61.91 -37.17 77.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.161 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.68 -38.12 73.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.065 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 78' ' ' THR . 9.6 t80 -60.35 -49.08 78.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.468 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -62.91 -37.28 86.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.602 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -42.77 85.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.703 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.5 mt -72.75 -30.72 64.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.975 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.898 HG23 ' O ' ' A' ' 74' ' ' TYR . 23.0 p -71.07 126.83 92.06 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.862 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.0 140.06 79.8 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.438 2.092 . . . . 0.0 112.103 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.884 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 98' ' ' GLY . . . . . 0.469 ' HA2' HD21 ' B' ' 101' ' ' LEU . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.534 -0.227 . . . . 0.0 112.534 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.74 -41.16 2.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.928 0.394 . . . . 0.0 111.037 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.45 ' HB3' HD22 ' A' ' 65' ' ' LEU . 6.9 mt -115.45 -33.17 5.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.158 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.47 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -54.21 -40.55 67.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.993 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.553 ' HA ' HD21 ' B' ' 105' ' ' LEU . 0.6 OUTLIER -66.84 -31.99 72.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.86 -34.9 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.053 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.006 HG22 ' HB1' ' A' ' 6' ' ' ALA . 25.2 t -70.85 -55.19 14.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.342 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.587 HD12 ' N ' ' B' ' 106' ' ' GLU . 2.8 pp -58.6 -40.98 84.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.803 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 106' ' ' GLU . . . . . 0.587 ' N ' HD12 ' B' ' 105' ' ' LEU . 10.5 tt0 -73.7 -33.42 64.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.804 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.57 -48.35 79.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.039 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' B' ' 112' ' ' LYS . 0.3 OUTLIER -71.38 -48.97 46.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.864 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 10.0 mt -50.93 -38.66 51.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.499 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.88 -34.06 57.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.117 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 mp -66.37 -15.37 63.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.301 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' B' ' 108' ' ' TYR . 6.0 mmmm -72.09 -73.86 0.18 Allowed 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.775 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.921 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 ttm . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.81 0.338 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 3' ' ' ARG . 1.2 t0 -178.37 139.26 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.783 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 2' ' ' ASP . 10.3 mpt_? 69.93 -54.2 0.61 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.652 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.6 tttp -58.69 -33.4 70.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.9 0.381 . . . . 0.0 110.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 51.6 t -59.89 -38.66 77.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.804 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.71 -51.04 54.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.27 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.437 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -67.04 -26.88 66.97 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.108 179.392 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -72.64 -48.84 36.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.388 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.924 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -68.44 -42.86 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' CD ' HG12 ' B' ' 104' ' ' VAL . 2.1 tpt180 -58.26 -46.12 86.57 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.095 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.7 t-160 -56.54 -42.05 77.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -60.75 -35.92 77.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.292 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.673 HG22 HD22 ' A' ' 58' ' ' LEU . 60.5 t -60.67 -49.84 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.601 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -57.75 -39.34 77.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.501 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -69.12 -30.12 68.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.735 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.452 HD13 ' HG2' ' A' ' 57' ' ' PRO . 82.4 mt -96.43 -0.22 49.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.621 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.991 HD11 HD11 ' A' ' 58' ' ' LEU . 91.4 mt -143.95 69.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 CA-C-O 122.122 0.963 . . . . 0.0 110.374 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -76.07 -2.81 32.63 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.88 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -71.66 -23.54 61.69 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 t0 78.55 -55.83 0.47 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.19 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -51.91 57.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.857 0.36 . . . . 0.0 111.245 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.49 ' HB2' HG23 ' A' ' 17' ' ' ILE . 22.6 mt-10 -50.88 -34.75 29.52 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -71.02 -34.46 71.32 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.89 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -45.09 96.06 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.114 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.886 ' O ' HG23 ' A' ' 29' ' ' VAL . 10.6 t80 -64.57 -41.39 96.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.149 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.608 HD23 HG11 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -60.69 -36.57 79.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.533 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -64.6 -47.38 78.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.612 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.4 -37.22 86.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.594 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 25' ' ' TYR . 40.8 t -69.34 -36.39 71.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.608 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.974 HD21 HD11 ' A' ' 62' ' ' ILE . 14.0 mt -68.53 -43.95 75.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.54 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -36.75 84.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.382 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.76 ' CE ' HG21 ' A' ' 36' ' ' THR . 0.0 OUTLIER -63.97 -48.23 77.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.202 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.715 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.1 t80 -55.51 -43.06 75.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.992 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -74.78 -38.45 62.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.782 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -55.08 5.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.76 HG21 ' CE ' ' A' ' 32' ' ' MET . 63.2 p -82.9 -13.81 55.38 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.432 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 20.5 mmt 60.45 21.18 10.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.768 0.318 . . . . 0.0 110.929 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.8 OUTLIER -94.52 113.11 24.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.857 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.8 t -82.12 -23.32 9.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.225 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.82 -28.8 58.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.986 0.422 . . . . 0.0 110.915 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.611 HG23 ' HB3' ' A' ' 38' ' ' ASP . 53.8 t -73.42 -43.93 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.841 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.715 HD22 ' CG ' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -69.23 -37.04 77.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.678 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 39' ' ' VAL . 71.7 t -62.09 -46.38 96.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.955 0.407 . . . . 0.0 110.144 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -58.42 -56.63 24.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.995 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.602 ' HA ' HD12 ' A' ' 48' ' ' LEU . 64.7 m-20 -60.6 -36.94 79.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 110.447 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.851 HD22 ' CD1' ' A' ' 50' ' ' ILE . 10.4 mt -52.45 -46.21 66.35 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.523 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.8 mptt -55.42 -46.38 76.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.543 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.602 HD12 ' HA ' ' A' ' 45' ' ' ASP . 5.1 mt -54.41 -39.47 67.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.641 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.608 HG11 HD23 ' A' ' 26' ' ' LEU . 14.4 p -101.13 8.61 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.272 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.851 ' CD1' HD22 ' A' ' 46' ' ' LEU . 88.3 mt -144.79 28.68 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 121.305 0.574 . . . . 0.0 110.666 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' ' O ' ' A' ' 47' ' ' LYS . 21.9 p-10 -86.21 10.35 14.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.219 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -133.4 155.97 80.21 Favored Pre-proline 0 C--N 1.334 -0.084 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.249 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.559 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.4 Cg_endo -52.29 -38.84 73.21 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.824 2.349 . . . . 0.0 112.086 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.75 -34.18 75.15 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.461 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.844 ' O ' HG23 ' A' ' 50' ' ' ILE . 87.1 mtt180 -94.49 -1.21 53.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.743 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 53' ' ' PRO . 11.9 mt -64.73 -47.41 75.45 Favored Pre-proline 0 CA--C 1.53 0.203 0 CA-C-O 120.605 0.24 . . . . 0.0 111.644 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.52 -26.81 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.732 2.288 . . . . 0.0 113.605 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.991 HD11 HD11 ' A' ' 17' ' ' ILE . 20.8 mt -69.71 -34.84 74.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.725 0.298 . . . . 0.0 111.242 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.501 ' CD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -56.52 -48.38 77.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.01 0.433 . . . . 0.0 110.887 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.474 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.0 p-10 -75.28 -31.01 60.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.867 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.924 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.69 -56.96 14.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.996 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.974 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -67.49 -37.64 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.458 -178.905 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.608 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 11.6 ttm-85 -37.37 -59.88 0.96 Allowed Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 90.8 Cg_exo -38.24 -37.14 0.6 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.86 2.373 . . . . 0.0 113.094 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.667 HD13 HD12 ' B' ' 101' ' ' LEU . 12.3 mt -65.2 -54.11 34.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.369 0.604 . . . . 0.0 110.047 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.53 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -44.31 129.02 4.67 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.148 179.552 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.404 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 78.4 Cg_exo -50.62 165.27 0.43 Allowed 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.63 2.22 . . . . 0.0 112.424 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.786 ' O ' HG23 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -56.16 -49.21 74.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.296 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -46.62 81.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.137 0.494 . . . . 0.0 110.418 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.561 ' CG ' HG21 ' A' ' 39' ' ' VAL . 29.2 m170 -64.95 -30.2 71.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.85 -32.28 69.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 0.0 110.298 179.547 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 68' ' ' LEU . 29.4 t -67.9 -46.2 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.061 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -69.18 -38.49 78.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.227 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.526 ' O ' HG23 ' A' ' 78' ' ' THR . 11.3 t80 -60.91 -42.68 98.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.335 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.41 ' O ' ' HD3' ' A' ' 79' ' ' PRO . 3.5 t0 -62.27 -48.72 78.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.522 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -66.63 -18.85 65.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.34 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.6 mt -86.58 -27.76 23.7 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.548 ' OG1' ' HD3' ' A' ' 79' ' ' PRO . 1.4 p -57.13 -46.03 99.88 Favored Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.548 ' HD3' ' OG1' ' A' ' 78' ' ' THR . 63.9 Cg_endo -72.89 -43.96 0.71 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.043 1.829 . . . . 0.0 112.2 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.928 -179.926 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 12.7 p 59.08 -172.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.299 . . . . 0.0 110.83 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.451 ' O ' HG23 ' B' ' 104' ' ' VAL . 65.6 mt 69.69 -58.14 0.53 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.466 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.667 HD12 HD13 ' A' ' 65' ' ' LEU . 8.6 tp -51.63 -52.64 46.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.827 0.346 . . . . 0.0 110.984 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -31.5 65.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.674 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -69.86 -32.58 71.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.804 HG22 ' HB1' ' A' ' 6' ' ' ALA . 1.6 t -71.04 -43.27 76.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.668 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.523 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.7 OUTLIER -65.67 -45.59 82.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.258 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.52 -33.64 73.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.63 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.79 -50.45 73.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.024 0.44 . . . . 0.0 110.899 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -74.43 -48.89 24.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.764 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' B' ' 109' ' ' LEU . 13.8 mt -51.33 -41.39 60.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.704 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 73.3 mtt180 -76.89 -33.87 57.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.283 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.502 ' C ' HD23 ' B' ' 111' ' ' LEU . 0.4 OUTLIER -65.35 -16.03 63.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.053 179.023 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 3.9 mmtp -75.16 -76.94 0.13 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.917 0.389 . . . . 0.0 110.824 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.2 mtmt . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.896 -179.969 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.818 0.342 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.48 152.64 18.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 80.38 -41.32 0.2 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.645 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -59.02 -33.38 70.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.754 0.311 . . . . 0.0 110.763 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -56.95 -38.61 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.012 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.976 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.33 -50.93 58.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.071 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.415 ' HD2' ' HB3' ' B' ' 107' ' ' ASP . 0.0 OUTLIER -63.75 -26.92 68.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.238 179.432 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -49.15 51.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.626 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.669 ' HE2' HG21 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.18 -43.19 74.72 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.802 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.514 ' NH1' HD13 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -56.88 -45.2 82.7 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.907 178.611 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 14.6 t-160 -57.69 -41.82 82.42 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.117 0.484 . . . . 0.0 109.852 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -60.14 -35.98 76.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.001 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.66 HG13 ' CD2' ' A' ' 58' ' ' LEU . 48.0 t -61.21 -47.7 92.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.32 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -57.6 -39.03 75.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.149 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -69.0 -34.66 75.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.429 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 17' ' ' ILE . 69.5 mt -95.88 6.28 49.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.508 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.609 ' O ' HG22 ' A' ' 17' ' ' ILE . 39.2 mm -148.08 69.03 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-O 121.708 0.766 . . . . 0.0 110.081 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.56 -33.51 66.21 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.016 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.82 164.26 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.771 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -98.82 -32.7 11.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.942 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.93 63.16 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.953 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' HG23 ' A' ' 17' ' ' ILE . 27.0 mt-10 -50.87 -34.69 29.16 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.064 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 19.3 mttt -73.29 -34.77 65.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.947 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.73 -40.57 97.07 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.14 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.897 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -67.17 -43.65 81.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 179.381 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.468 HD22 HG11 ' A' ' 13' ' ' VAL . 28.2 tp -61.5 -38.11 86.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.647 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 20.5 m-85 -63.22 -46.3 87.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.664 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -38.07 88.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.626 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 25' ' ' TYR . 34.8 t -62.24 -47.09 94.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.878 HD21 HD11 ' A' ' 62' ' ' ILE . 17.0 mt -64.39 -44.79 90.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.496 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -65.4 -35.09 79.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.415 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.404 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -68.34 -44.71 74.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.442 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.976 ' CD2' HD13 ' B' ' 101' ' ' LEU . 8.9 t80 -61.08 -36.07 78.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.115 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -74.43 -41.0 61.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.581 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.597 ' HG3' HG23 ' A' ' 36' ' ' THR . 15.7 pt20 -77.43 -52.51 9.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.987 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.597 HG23 ' HG3' ' A' ' 35' ' ' GLN . 17.7 p -79.38 -21.93 45.04 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.8 mmt 60.66 22.39 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.672 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.456 ' HB3' HG23 ' A' ' 41' ' ' VAL . 8.2 m-20 -104.13 119.77 39.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.776 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.76 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.9 t -79.14 -18.29 13.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.237 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.16 -29.63 48.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.456 HG23 ' HB3' ' A' ' 38' ' ' ASP . 46.6 t -73.47 -44.41 54.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.662 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.759 HD12 HD12 ' A' ' 46' ' ' LEU . 1.2 pp -68.98 -38.31 79.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.767 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 39' ' ' VAL . 70.8 t -66.82 -37.32 79.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.917 0.389 . . . . 0.0 110.422 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.4 -57.96 14.47 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.68 -0.772 . . . . 0.0 111.894 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.69 -41.7 99.25 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.945 0.403 . . . . 0.0 110.634 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.839 ' HG ' HG11 ' A' ' 29' ' ' VAL . 11.2 mt -52.19 -40.17 61.15 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.622 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -59.92 -46.61 88.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.386 179.468 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 mt -55.53 -36.72 67.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.485 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.631 HG13 HG13 ' A' ' 50' ' ' ILE . 14.6 p -101.13 4.53 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.394 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.916 HG23 ' O ' ' A' ' 55' ' ' ARG . 73.9 mt -142.52 29.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.26 0.552 . . . . 0.0 110.997 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.486 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.3 p30 -87.51 16.72 5.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.917 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.409 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 5.0 mm-40 -129.54 142.54 45.63 Favored Pre-proline 0 C--N 1.333 -0.11 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.65 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.538 ' HA ' HD12 ' A' ' 56' ' ' LEU . 85.7 Cg_exo -45.69 -39.01 17.83 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.205 1.936 . . . . 0.0 111.835 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 t -69.25 -35.14 75.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.698 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.916 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -89.96 -10.5 44.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.74 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.1 mt -53.08 -46.11 97.86 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 95.6 Cg_exo -44.17 -26.57 1.56 Allowed 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.727 2.285 . . . . 0.0 113.67 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.66 ' CD2' HG13 ' A' ' 13' ' ' VAL . 26.5 mt -73.67 -30.25 62.79 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.064 -0.254 . . . . 0.0 111.114 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.532 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -69.72 -44.35 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.987 0.422 . . . . 0.0 110.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.31 -31.42 60.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.848 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.523 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.66 -57.32 10.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.656 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.878 HD11 HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -65.83 -31.46 53.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.514 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.466 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 2.7 ttp180 -40.04 -59.58 1.75 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.5 Cg_endo -48.81 -26.1 9.27 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.801 2.334 . . . . 0.0 113.348 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.616 HD11 ' CE2' ' A' ' 9' ' ' PHE . 21.0 mt -65.01 -54.54 28.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.35 0.595 . . . . 0.0 109.694 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.582 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.1 mp -42.07 136.03 2.26 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.425 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.46 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 54.2 Cg_exo -52.24 165.79 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.807 2.338 . . . . 0.0 112.46 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.3 -55.96 25.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.16 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -50.24 74.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.419 . . . . 0.0 110.435 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.582 ' CB ' HG23 ' A' ' 66' ' ' ILE . 26.8 m170 -61.73 -28.24 69.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.178 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.77 -43.72 98.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.92 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.3 t -62.31 -45.22 99.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.96 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.04 -30.75 71.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.828 ' O ' HG23 ' A' ' 78' ' ' THR . 4.5 t80 -62.01 -50.27 72.72 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.672 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.47 -42.23 98.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.678 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -59.24 -35.09 73.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.666 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.5 mt -81.55 -33.13 31.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.821 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.828 HG23 ' O ' ' A' ' 74' ' ' TYR . 22.4 p -85.21 109.56 22.12 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.983 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.84 134.9 31.21 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.348 2.032 . . . . 0.0 112.375 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.801 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.19 83.83 2.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.933 0.397 . . . . 0.0 110.927 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.433 ' HB3' HD22 ' A' ' 65' ' ' LEU . 0.7 OUTLIER -66.32 -39.26 89.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.927 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.976 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.3 OUTLIER -56.46 -36.75 69.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.928 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.558 ' HA ' HD21 ' B' ' 105' ' ' LEU . 3.8 tttt -68.54 -32.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.819 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.96 -37.31 75.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.082 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.976 HG22 ' HB1' ' A' ' 6' ' ' ALA . 33.2 t -69.58 -54.54 19.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.518 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.57 HD12 ' N ' ' B' ' 106' ' ' GLU . 2.4 pp -57.34 -39.8 76.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.677 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 106' ' ' GLU . . . . . 0.57 ' N ' HD12 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -73.01 -34.86 66.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.342 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.415 ' HB3' ' HD2' ' A' ' 7' ' ' ARG . 1.6 m-20 -65.19 -36.76 85.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.622 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.444 ' CE2' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -69.54 -48.43 60.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.3 179.593 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 61.9 mt -53.04 -40.6 64.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.697 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' ARG . . . . . 0.406 ' CZ ' ' HB2' ' B' ' 110' ' ' ARG . 4.8 ptm85 -76.83 -39.17 52.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.007 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.514 HD13 ' NH1' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -72.18 -6.83 45.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.762 179.355 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -85.94 -78.6 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.854 0.359 . . . . 0.0 110.93 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.942 179.972 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 mtm . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 120.911 0.386 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.67 -30.15 19.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.95 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -31.07 70.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -59.61 -39.22 83.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.4 t -61.13 -35.06 63.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.882 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.968 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.02 -51.18 41.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.236 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.466 ' HA ' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -67.64 -26.87 66.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.25 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -73.18 -46.06 52.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.953 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.92 -44.74 65.56 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -63.89 -35.99 82.48 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 179.259 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.465 ' N ' ' HG3' ' A' ' 10' ' ' ARG . 1.2 t60 -62.32 -42.66 99.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -61.1 -35.91 78.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.82 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.89 HG22 HD23 ' A' ' 58' ' ' LEU . 64.0 t -62.84 -44.85 99.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.306 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.48 -42.21 82.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.958 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -69.15 -37.17 78.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.267 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.3 mt -89.9 6.06 43.61 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.417 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.662 ' O ' HG22 ' A' ' 17' ' ' ILE . 37.4 mm -145.91 67.98 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 CA-C-O 121.743 0.782 . . . . 0.0 110.208 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.41 -31.26 67.55 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.917 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -73.32 122.27 21.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -62.88 -27.55 69.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.106 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.34 -52.02 63.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.899 0.38 . . . . 0.0 111.079 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.544 ' HB2' HG23 ' A' ' 17' ' ' ILE . 28.5 mt-10 -50.8 -34.59 28.14 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -71.72 -34.7 69.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.815 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.63 97.55 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.13 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.876 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -65.4 -44.71 86.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.333 179.326 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.44 -41.75 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.539 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -59.62 -43.25 93.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.523 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.65 -35.99 82.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.459 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.946 HG12 HD23 ' A' ' 42' ' ' LEU . 24.4 t -65.6 -44.98 93.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.849 HD21 HD11 ' A' ' 62' ' ' ILE . 19.2 mt -63.85 -44.4 93.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.489 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.6 mtp180 -59.73 -34.06 72.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.475 ' HG2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -65.21 -52.12 56.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.495 179.5 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' A' ' 37' ' ' MET . 6.3 t80 -55.98 -34.36 65.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.123 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -74.84 -43.95 51.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.805 0.336 . . . . 0.0 111.109 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.74 -54.91 5.8 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 p -84.42 -33.08 23.79 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.546 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.2 mmt 63.77 39.28 8.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.987 0.422 . . . . 0.0 110.665 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -113.71 125.21 53.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.73 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.858 ' O ' HG23 ' A' ' 43' ' ' VAL . 17.2 t -75.76 -14.0 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.988 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.71 -38.94 37.8 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.996 0.427 . . . . 0.0 110.215 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.475 HG11 ' HG2' ' A' ' 32' ' ' MET . 37.8 t -69.41 -34.04 60.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.88 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.961 HD22 HD11 ' A' ' 46' ' ' LEU . 1.7 mt -66.55 -50.71 62.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.549 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.858 HG23 ' O ' ' A' ' 39' ' ' VAL . 32.1 t -61.61 -38.13 79.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.29 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.61 -56.65 23.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.821 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.586 ' HB3' HG22 ' A' ' 29' ' ' VAL . 69.7 m-20 -72.95 -41.32 64.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.74 0.305 . . . . 0.0 111.341 -179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.961 HD11 HD22 ' A' ' 42' ' ' LEU . 30.5 mt -50.33 -45.19 54.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.949 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -61.78 -46.72 88.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.699 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.481 HD13 ' OH ' ' A' ' 25' ' ' TYR . 1.6 mt -50.83 -37.69 44.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.064 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.524 HG13 HG13 ' A' ' 50' ' ' ILE . 11.2 p -101.04 -6.55 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.491 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.884 HG23 ' O ' ' A' ' 55' ' ' ARG . 7.4 mt -129.3 31.0 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.105 0.479 . . . . 0.0 111.303 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.474 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.3 p30 -86.68 16.2 4.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.743 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -127.33 141.21 40.14 Favored Pre-proline 0 C--N 1.334 -0.1 0 C-N-CA 120.986 -0.285 . . . . 0.0 110.659 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.435 ' HA ' HD12 ' A' ' 56' ' ' LEU . 88.8 Cg_exo -46.15 -38.49 19.58 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.267 1.978 . . . . 0.0 111.678 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.5 p -69.36 -34.77 75.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.492 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.884 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -88.4 -13.91 39.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.589 -179.72 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.653 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 17.1 mt -50.34 -50.71 69.37 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 4.3 Cg_exo -40.06 -28.83 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.291 2.661 . . . . 0.0 113.754 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.89 HD23 HG22 ' A' ' 13' ' ' VAL . 7.5 mt -65.69 -32.04 73.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.767 0.318 . . . . 0.0 111.002 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.591 ' HD1' HG21 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -60.88 -40.65 93.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.319 179.52 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.408 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -75.13 -31.36 61.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.481 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.953 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -65.12 -57.91 7.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.198 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.881 HG13 HD12 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -65.35 -35.58 75.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.749 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.466 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 7.8 ttp180 -38.55 -58.25 1.65 Allowed Pre-proline 0 N--CA 1.468 0.44 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 9.5 Cg_endo -51.92 -28.42 31.52 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.597 2.198 . . . . 0.0 112.869 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.881 HD12 HG13 ' A' ' 62' ' ' ILE . 20.4 mt -65.2 -44.5 88.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.673 0.749 . . . . 0.0 109.371 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.581 HD11 HD13 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -62.54 130.08 93.18 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.643 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -51.86 165.46 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.566 2.177 . . . . 0.0 112.218 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -55.55 30.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.075 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmtt -57.36 -54.2 49.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.034 0.445 . . . . 0.0 110.417 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 14.8 m170 -59.6 -28.32 67.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.454 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -61.72 -44.07 97.62 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 30.7 t -65.2 -45.06 94.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.275 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.11 -27.04 67.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.444 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.786 ' O ' HG23 ' A' ' 78' ' ' THR . 56.7 t80 -72.49 -46.12 56.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.517 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.21 -45.79 91.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.841 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -66.33 -40.87 90.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.064 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.462 ' CB ' HG21 ' A' ' 43' ' ' VAL . 22.9 mt -60.2 -35.53 75.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.202 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.786 HG23 ' O ' ' A' ' 74' ' ' TYR . 13.6 p -52.54 107.25 0.79 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.159 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -81.04 -167.45 0.51 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.488 2.126 . . . . 0.0 112.389 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 121.001 0.429 . . . . 0.0 110.931 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 26.0 t -173.37 -78.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.863 0.363 . . . . 0.0 110.983 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' A' ' 65' ' ' LEU . 7.9 mt -81.96 -39.95 22.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.99 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.486 ' HA ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -53.5 -52.57 59.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 179.941 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.428 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -55.42 -32.74 62.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -39.27 85.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.968 HG22 ' HB1' ' A' ' 6' ' ' ALA . 21.7 t -71.03 -31.46 45.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.285 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.658 HD21 HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -68.53 -45.67 71.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.905 0.383 . . . . 0.0 110.3 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -69.4 -34.01 73.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.564 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.586 ' O ' HD12 ' B' ' 111' ' ' LEU . 79.0 m-20 -60.96 -45.53 94.37 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.638 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.4 ' CE2' ' HD2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -72.5 -49.37 33.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.65 179.688 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 73.3 mt -52.86 -41.56 64.42 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.807 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 21.5 mtt-85 -76.8 -36.11 57.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.542 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.586 HD12 ' O ' ' B' ' 107' ' ' ASP . 2.1 mt -73.05 -7.36 50.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.494 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 4.0 mttm -84.97 -76.45 0.31 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 121.039 0.447 . . . . 0.0 110.915 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.89 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.768 0.318 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -178.36 -39.47 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.86 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.06 -30.49 24.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.906 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -39.08 81.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.056 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.92 -40.66 63.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.213 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.57 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -66.07 -50.85 62.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 9.3 mtp180 -65.09 -26.72 68.34 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.01 -49.11 48.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.754 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.884 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.71 -41.61 71.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.071 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.17 92.53 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.818 178.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 12.3 m170 -59.29 -41.16 88.3 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 179.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -61.49 -34.52 75.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.171 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.806 HG13 ' CD2' ' A' ' 58' ' ' LEU . 47.8 t -62.13 -48.58 87.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -57.51 -40.18 78.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.175 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -69.06 -32.91 72.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.388 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -98.54 8.29 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.466 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.738 HG23 ' HB2' ' A' ' 22' ' ' GLU . 35.2 mm -147.68 68.56 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-O 121.721 0.772 . . . . 0.0 110.287 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -81.33 -8.82 59.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.274 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -66.93 -13.28 61.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.539 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.8 -61.61 0.49 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.609 0.242 . . . . 0.0 110.921 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.66 -48.73 66.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.916 0.388 . . . . 0.0 110.834 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.738 ' HB2' HG23 ' A' ' 17' ' ' ILE . 40.9 mt-10 -50.99 -34.45 29.13 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.78 -35.97 75.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.074 179.006 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.43 -44.61 86.8 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.998 0.428 . . . . 0.0 110.397 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 29' ' ' VAL . 13.4 t80 -60.84 -44.17 97.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.587 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.535 HD11 HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -59.29 -40.84 87.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.734 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -61.93 -41.43 97.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.768 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.36 -36.19 82.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.581 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.834 HG11 ' HG ' ' A' ' 46' ' ' LEU . 41.1 t -69.76 -36.63 70.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.835 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.78 HD21 HD11 ' A' ' 62' ' ' ILE . 11.4 mt -70.24 -43.59 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.652 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.5 ttt85 -66.81 -35.45 80.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.485 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 23.7 tpp -69.14 -43.76 73.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.397 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.659 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.3 t80 -62.13 -39.64 93.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.905 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.552 ' CE1' ' HG3' ' B' ' 102' ' ' LYS . 56.1 t60 -74.86 -41.38 59.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.399 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -54.99 5.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.855 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 p -76.53 -23.14 53.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.84 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.437 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.5 mmt 63.64 18.38 11.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.771 0.319 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.618 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.0 OUTLIER -97.87 116.6 30.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.757 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.794 ' O ' HG23 ' A' ' 43' ' ' VAL . 19.5 t -79.41 -21.41 12.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.203 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.33 -30.81 54.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.877 0.37 . . . . 0.0 110.697 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.618 HG23 ' HB3' ' A' ' 38' ' ' ASP . 40.8 t -73.55 -41.88 55.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.677 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.685 HD12 HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -69.75 -38.09 76.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.696 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 39' ' ' VAL . 76.4 t -65.87 -37.21 79.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 CA-C-O 120.961 0.41 . . . . 0.0 110.212 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.04 -57.98 13.65 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.962 179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -60.92 -44.37 97.28 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.021 0.438 . . . . 0.0 110.472 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.834 ' HG ' HG11 ' A' ' 29' ' ' VAL . 10.7 mt -51.02 -40.73 58.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.3 OUTLIER -59.34 -50.24 74.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.271 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mp -51.45 -37.25 47.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.811 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.609 HG13 HG13 ' A' ' 50' ' ' ILE . 14.9 p -101.0 3.7 10.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.435 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.855 HG23 ' O ' ' A' ' 55' ' ' ARG . 71.3 mt -140.4 29.64 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' A' ' 47' ' ' LYS . 2.3 m120 -84.32 11.19 8.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.871 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.417 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 20.1 mm-40 -127.3 148.76 67.53 Favored Pre-proline 0 C--O 1.231 0.103 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.807 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.451 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.69 -37.8 65.0 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.45 2.1 . . . . 0.0 111.445 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.29 -32.49 71.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.296 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.855 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.9 mtp180 -91.31 -9.22 45.81 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.391 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.5 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 18.1 mt -57.01 -44.55 99.83 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.718 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.17 -27.34 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.689 2.26 . . . . 0.0 113.577 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.806 ' CD2' HG13 ' A' ' 13' ' ' VAL . 15.8 mt -70.51 -30.27 66.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.692 0.282 . . . . 0.0 111.037 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.486 ' HE1' ' HH ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.378 . . . . 0.0 110.637 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.419 ' O ' ' HD2' ' A' ' 64' ' ' PRO . 3.0 m-20 -75.48 -31.27 60.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.805 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.884 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -65.57 -64.49 0.85 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.453 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.78 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.7 -28.32 44.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.447 ' HG2' ' CE2' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -41.72 -63.96 0.75 Allowed Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -178.857 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.43 ' HG2' ' O ' ' A' ' 61' ' ' ALA . 2.4 Cg_endo -46.25 -26.98 4.26 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.963 2.442 . . . . 0.0 113.214 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.572 HD12 ' CG1' ' A' ' 62' ' ' ILE . 16.1 mt -65.41 -51.86 57.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 109.542 179.365 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.445 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.0 OUTLIER -47.68 129.89 11.05 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.7 -1.137 . . . . 0.0 111.156 179.458 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.443 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 53.7 Cg_exo -52.86 165.8 1.08 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.693 2.262 . . . . 0.0 112.418 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.9 mt -54.94 -56.85 15.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.135 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -54.6 44.58 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.249 0.547 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.445 ' CB ' HG23 ' A' ' 66' ' ' ILE . 20.1 m170 -57.54 -29.35 64.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.219 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.74 -44.26 96.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.846 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -59.29 -46.68 92.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.824 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.47 -31.13 71.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.99 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.651 ' HE1' HD11 ' A' ' 42' ' ' LEU . 2.3 t80 -59.99 -49.79 76.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.354 179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -59.46 -48.26 82.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.76 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -66.3 -19.11 65.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.512 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.407 ' HB3' HG11 ' A' ' 43' ' ' VAL . 44.7 mt -89.03 -24.71 22.27 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.615 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 2.3 p -57.51 -44.94 99.86 Favored Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.615 ' HD2' ' N ' ' A' ' 78' ' ' THR . 44.0 Cg_endo -67.76 -26.82 38.45 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 121.882 1.721 . . . . 0.0 112.231 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.949 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 99' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' B' ' 100' ' ' LEU . 22.9 t -110.57 177.16 4.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.631 0.253 . . . . 0.0 110.855 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' B' ' 99' ' ' SER . 17.5 mt 68.06 -57.57 0.47 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.718 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.609 HD22 ' CE2' ' A' ' 33' ' ' TYR . 1.8 pp -51.59 -40.58 60.09 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.764 0.316 . . . . 0.0 110.871 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.552 ' HG3' ' CE1' ' A' ' 34' ' ' HIS . 0.7 OUTLIER -61.64 -33.84 74.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.329 179.269 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.04 -32.43 70.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.569 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.705 HG11 ' CZ ' ' A' ' 9' ' ' PHE . 2.0 t -68.78 -39.92 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.48 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.57 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.5 OUTLIER -65.12 -45.64 84.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.334 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -33.83 73.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.616 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.46 -50.48 73.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.735 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' B' ' 112' ' ' LYS . 0.3 OUTLIER -70.58 -46.14 64.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.691 179.796 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 11.0 mt -51.12 -37.62 47.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.521 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -76.94 -35.54 57.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.922 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.15 -15.76 62.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.194 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' B' ' 108' ' ' TYR . 5.1 mmmm -70.49 -73.85 0.16 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-O 120.957 0.408 . . . . 0.0 110.771 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.915 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.785 0.326 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.467 ' O ' HD21 ' B' ' 100' ' ' LEU . 17.3 p30 -147.05 29.94 0.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.959 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -92.04 -36.75 13.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.836 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.52 71.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.3 t -57.78 -38.34 64.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.26 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.788 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -68.1 -50.94 51.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.15 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -26.7 67.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.174 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.19 -48.27 52.55 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.461 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.738 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -70.77 -43.2 69.27 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.744 ' NH1' HD13 ' B' ' 111' ' ' LEU . 1.2 ttp180 -58.05 -42.18 84.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.696 178.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.04 -44.65 94.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.436 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HD2' ' HA ' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -61.58 -32.56 72.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.215 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 9' ' ' PHE . 49.0 t -62.32 -49.37 84.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.123 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -57.65 -37.94 74.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.851 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.92 -41.81 77.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.336 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.5 ' O ' HD13 ' A' ' 17' ' ' ILE . 3.4 mt -87.42 4.89 41.42 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.357 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.654 ' O ' HG22 ' A' ' 17' ' ' ILE . 41.6 mm -143.0 67.07 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-O 121.785 0.802 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -54.41 -31.25 54.7 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.975 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -73.13 164.64 26.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.619 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.32 -28.68 13.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.991 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.54 -51.64 67.74 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.533 ' HB2' HG23 ' A' ' 17' ' ' ILE . 27.4 mt-10 -50.9 -34.77 29.79 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 17.9 mttt -71.53 -34.9 70.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.966 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.97 -42.87 99.18 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -67.87 -40.5 83.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 179.451 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.504 HD22 HG11 ' A' ' 13' ' ' VAL . 0.1 OUTLIER -61.22 -46.03 92.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.63 179.675 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 15.4 m-30 -60.51 -42.65 96.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.729 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.73 -37.68 88.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.709 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 25' ' ' TYR . 46.6 t -63.62 -51.82 65.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.894 HD21 HD11 ' A' ' 62' ' ' ILE . 6.2 mt -60.56 -37.87 82.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.606 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.2 mmt-85 -65.23 -41.24 94.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.383 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.9 mmt -64.09 -46.83 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.462 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.692 ' CE1' HG22 ' A' ' 39' ' ' VAL . 13.0 t80 -59.59 -37.79 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.043 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -74.71 -44.76 48.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.563 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -55.15 5.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.151 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -75.21 -20.78 59.09 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.413 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 1.3 mmt 61.11 20.15 10.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.68 0.276 . . . . 0.0 110.7 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.485 ' HB3' HG23 ' A' ' 41' ' ' VAL . 3.9 t0 -104.73 120.68 41.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.91 0.386 . . . . 0.0 110.864 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.831 ' O ' HG23 ' A' ' 43' ' ' VAL . 44.5 t -79.67 -16.61 13.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.21 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.51 -28.45 56.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.879 0.371 . . . . 0.0 110.947 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.485 HG23 ' HB3' ' A' ' 38' ' ' ASP . 53.2 t -73.18 -45.25 54.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.751 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.736 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.4 pp -67.92 -38.6 83.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.751 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 39' ' ' VAL . 71.2 t -61.03 -38.99 80.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.003 0.43 . . . . 0.0 110.372 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.71 -59.19 8.47 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.157 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.466 ' CB ' HG22 ' A' ' 29' ' ' VAL . 76.6 m-20 -60.53 -45.03 95.33 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.781 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.811 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.9 mt -50.81 -44.48 59.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.2 tppt? -57.91 -46.61 84.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.567 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.09 -37.64 64.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.736 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.5 p -100.97 2.87 10.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.468 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.874 HG23 ' O ' ' A' ' 55' ' ' ARG . 53.2 mt -139.13 29.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.406 0.622 . . . . 0.0 110.955 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.478 ' N ' ' O ' ' A' ' 47' ' ' LYS . 28.6 p30 -86.28 17.65 3.59 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.873 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.431 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 24.2 mm-40 -126.03 141.22 38.94 Favored Pre-proline 0 N--CA 1.458 -0.05 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.439 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.464 ' HA ' HD12 ' A' ' 56' ' ' LEU . 85.4 Cg_exo -45.42 -38.9 16.24 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.157 1.905 . . . . 0.0 111.884 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.2 t -69.4 -36.03 76.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.851 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.874 ' O ' HG23 ' A' ' 50' ' ' ILE . 61.0 mtt85 -87.82 -15.73 36.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.768 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.653 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 15.8 mt -46.54 -51.92 33.35 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.0 Cg_exo -39.13 -29.17 0.18 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.358 2.706 . . . . 0.0 113.739 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.591 HD21 HG13 ' A' ' 13' ' ' VAL . 1.0 OUTLIER -60.61 -30.14 69.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.821 0.344 . . . . 0.0 111.041 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.634 ' HD1' HG21 ' A' ' 50' ' ' ILE . 2.0 m-85 -69.61 -40.32 76.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 7.1 m-20 -75.28 -31.07 60.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.937 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.604 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.93 -61.85 1.63 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.047 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.894 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -58.34 -36.17 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.968 -179.27 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 17.9 ttp180 -41.35 -66.68 0.37 Allowed Pre-proline 0 CA--C 1.538 0.487 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.11 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 88.9 Cg_exo -34.55 -33.62 0.08 OUTLIER 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.309 2.673 . . . . 0.0 113.497 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.481 HD11 ' CE2' ' A' ' 9' ' ' PHE . 6.8 mt -64.77 -53.59 44.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 110.141 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.622 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.6 OUTLIER -38.74 128.89 1.15 Allowed Pre-proline 0 CA--C 1.537 0.463 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.647 179.595 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.405 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 50.8 Cg_exo -54.08 165.7 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.687 2.258 . . . . 0.0 112.251 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.9 mt -52.21 -51.28 59.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.264 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.628 ' O ' HG12 ' A' ' 72' ' ' VAL . 7.7 mmtm -57.89 -60.11 4.22 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.218 0.532 . . . . 0.0 110.387 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.622 ' HB2' HG23 ' A' ' 66' ' ' ILE . 18.5 m170 -60.12 -19.87 55.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.618 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.21 -53.55 29.19 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.628 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.4 p -61.65 -35.26 66.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.248 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -70.92 -42.99 69.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.088 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.919 ' O ' HG23 ' A' ' 78' ' ' THR . 87.9 t80 -63.94 -44.46 92.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.232 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -39.72 85.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.396 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.447 ' OE1' HG22 ' A' ' 72' ' ' VAL . 29.9 mt-30 -59.22 -48.92 79.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.323 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' A' ' 74' ' ' TYR . 2.1 mt -62.72 -32.33 73.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.596 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.919 HG23 ' O ' ' A' ' 74' ' ' TYR . 5.7 p -88.02 155.63 52.4 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.798 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' A' ' 78' ' ' THR . 16.5 Cg_endo -57.6 107.48 0.3 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.542 2.161 . . . . 0.0 112.223 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.038 -179.957 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 69.3 p -138.06 67.92 1.41 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.974 0.416 . . . . 0.0 110.861 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.467 HD21 ' O ' ' A' ' 2' ' ' ASP . 6.0 mt -61.23 -48.39 81.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.836 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.618 HD13 HD21 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -51.76 -53.03 44.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -60.48 -31.81 70.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.777 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.56 -40.04 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.76 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.788 HG22 ' HB1' ' A' ' 6' ' ' ALA . 9.4 t -71.06 -40.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.856 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.618 HD21 HD13 ' B' ' 101' ' ' LEU . 1.1 mt -63.33 -45.7 90.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.035 0.445 . . . . 0.0 109.981 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -60.39 -38.69 84.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.466 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -60.93 -41.96 97.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.572 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.451 ' CZ ' ' HG2' ' A' ' 10' ' ' ARG . 3.4 m-85 -70.18 -48.46 57.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.682 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 13.6 mt -51.35 -39.75 57.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.769 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 14.3 mtt-85 -76.75 -36.31 57.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.488 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.744 HD13 ' NH1' ' A' ' 10' ' ' ARG . 0.5 OUTLIER -70.96 -9.33 57.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.539 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -78.5 -77.82 0.16 Allowed 'General case' 0 N--CA 1.457 -0.092 0 CA-C-O 120.857 0.36 . . . . 0.0 110.869 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.5 mttp . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.979 179.921 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.601 ' HA ' HD11 ' B' ' 100' ' ' LEU . 16.4 mtt . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.869 0.366 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -161.56 177.83 9.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.927 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.36 -36.45 76.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.74 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -65.0 -35.41 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.467 HG21 ' N ' ' A' ' 1' ' ' MET . 26.2 t -61.75 -35.05 65.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.202 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.055 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -68.69 -50.97 46.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.209 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 2.8 ttp180 -63.9 -26.84 68.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.422 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.73 -49.32 48.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.66 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.93 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.6 -43.36 72.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' HG3' ' CZ ' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -56.63 -44.76 81.57 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.933 178.401 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.4 t-160 -58.24 -42.75 87.03 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 109.817 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -59.62 -32.96 70.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.199 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.594 HG13 ' CD2' ' A' ' 58' ' ' LEU . 44.9 t -64.57 -47.58 88.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.58 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -57.6 -41.07 80.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.382 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.97 -31.42 70.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.742 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -101.4 8.96 41.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.611 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.664 ' O ' HG22 ' A' ' 17' ' ' ILE . 37.4 mm -149.06 69.04 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-O 121.701 0.763 . . . . 0.0 110.148 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.81 -36.13 76.11 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.789 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -63.79 150.17 45.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.672 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -86.89 -30.18 21.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.091 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.61 -52.63 63.57 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.004 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.544 ' CD ' HD12 ' A' ' 17' ' ' ILE . 17.2 mt-10 -50.88 -34.7 29.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 82.2 mttt -72.74 -34.27 66.92 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.89 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.1 -45.5 88.38 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.153 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.924 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.8 OUTLIER -62.49 -42.81 99.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.158 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.69 HD12 HG11 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -58.18 -40.99 82.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.441 179.405 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 13.4 m-30 -61.01 -43.03 99.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.293 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -68.61 -36.69 79.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.608 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 25' ' ' TYR . 32.6 t -64.56 -50.43 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.705 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.016 HD21 HD11 ' A' ' 62' ' ' ILE . 18.0 mt -60.62 -40.66 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.514 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.71 -39.07 87.18 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.329 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.6 mmt -60.71 -52.08 66.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.349 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.595 ' CG ' HD11 ' A' ' 42' ' ' LEU . 8.7 t80 -53.53 -40.82 65.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.323 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -74.39 -38.2 63.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.86 0.362 . . . . 0.0 111.354 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -54.87 5.89 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -86.22 -25.56 25.54 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.52 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.4 mmt 61.56 35.11 17.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 110.655 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.51 ' HB3' HG23 ' A' ' 41' ' ' VAL . 9.7 t0 -114.97 124.56 51.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.855 ' O ' HG23 ' A' ' 43' ' ' VAL . 15.8 t -76.74 -12.64 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.192 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.15 -36.05 55.58 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 120.948 0.404 . . . . 0.0 110.287 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.51 HG23 ' HB3' ' A' ' 38' ' ' ASP . 34.8 t -70.13 -34.93 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.129 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.78 ' CD2' HG12 ' A' ' 29' ' ' VAL . 7.3 mt -66.61 -49.18 67.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.585 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 39' ' ' VAL . 26.2 t -58.15 -37.48 62.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.073 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.26 -59.58 8.74 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.826 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.593 ' HA ' HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -68.07 -42.93 79.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.889 0.376 . . . . 0.0 111.21 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' A' ' 50' ' ' ILE . 41.7 mt -50.45 -47.53 56.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -58.27 -45.23 88.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 45' ' ' ASP . 3.1 mt -53.21 -40.88 64.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.69 HG11 HD12 ' A' ' 26' ' ' LEU . 14.8 p -101.08 4.22 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.449 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.874 HG23 ' O ' ' A' ' 55' ' ' ARG . 60.0 mt -140.2 29.55 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.217 0.532 . . . . 0.0 111.219 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.481 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.4 p30 -89.2 15.73 8.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.628 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -129.59 150.12 74.8 Favored Pre-proline 0 C--N 1.333 -0.132 0 C-N-CA 121.126 -0.229 . . . . 0.0 110.491 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.478 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.68 -38.69 66.61 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.325 2.017 . . . . 0.0 111.429 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 t -69.42 -36.8 77.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.608 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.874 ' O ' HG23 ' A' ' 50' ' ' ILE . 53.5 mtt85 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.647 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.682 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.1 mt -53.45 -49.78 86.55 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.682 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.7 Cg_endo -41.16 -27.91 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.022 2.482 . . . . 0.0 113.493 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.594 ' CD2' HG13 ' A' ' 13' ' ' VAL . 6.7 mt -70.74 -35.27 72.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.782 0.325 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.428 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -58.04 -44.73 87.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.265 179.325 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.2 OUTLIER -75.31 -31.08 60.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.675 179.512 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.93 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.31 -59.85 4.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 1.016 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.52 -38.04 76.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.34 -179.241 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.453 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -38.13 -66.29 0.31 Allowed Pre-proline 0 N--CA 1.469 0.476 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.772 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 82.3 Cg_exo -38.69 -32.12 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.835 2.357 . . . . 0.0 113.512 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.87 HD12 HG13 ' A' ' 62' ' ' ILE . 19.4 mt -65.44 -46.47 79.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.656 0.741 . . . . 0.0 109.851 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.472 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -54.52 133.47 63.4 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.18 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.74 165.56 0.73 Allowed 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.496 2.131 . . . . 0.0 112.168 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.2 tp -56.59 -57.09 13.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.979 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -57.86 -52.17 66.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.117 0.485 . . . . 0.0 110.388 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 22.7 m170 -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.452 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.26 -43.5 98.7 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.188 179.398 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.8 -45.87 97.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.118 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.14 93.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.072 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 78' ' ' THR . 53.5 t80 -59.85 -40.34 88.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.324 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.94 -53.39 57.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.561 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -66.71 -15.45 63.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.266 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.716 ' HB3' HG21 ' A' ' 43' ' ' VAL . 42.9 mt -91.96 -20.8 21.0 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 74' ' ' TYR . 7.4 p -56.89 -39.22 76.35 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.541 ' CD ' ' N ' ' A' ' 78' ' ' THR . 52.1 Cg_exo -55.1 -50.62 12.52 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.026 1.817 . . . . 0.0 112.286 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.769 -0.132 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.1 m 63.24 90.56 0.08 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.924 0.392 . . . . 0.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.601 HD11 ' HA ' ' A' ' 1' ' ' MET . 28.4 mt -93.93 -28.5 15.78 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.005 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.65 ' HA ' HD13 ' A' ' 65' ' ' LEU . 0.4 OUTLIER -52.02 -39.47 59.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.843 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.43 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 28.2 ttpp -61.01 -42.46 98.5 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.598 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.23 -38.48 83.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.897 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.055 HG22 ' HB1' ' A' ' 6' ' ' ALA . 23.8 t -68.03 -37.08 77.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.362 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.526 HD22 ' HB3' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -61.92 -44.06 97.56 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 178.993 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.51 -36.82 84.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.606 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -60.03 -40.32 88.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.457 ' CZ ' ' HG3' ' A' ' 10' ' ' ARG . 4.8 m-85 -73.53 -45.71 52.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.78 179.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 5.8 mt -51.01 -41.64 59.9 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.565 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -76.89 -34.32 57.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.119 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.4 -18.1 60.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.184 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -87.7 -47.05 8.96 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 121.004 0.43 . . . . 0.0 110.879 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.818 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.795 0.331 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.627 ' CB ' HD21 ' B' ' 100' ' ' LEU . 5.3 m-20 -132.43 31.64 4.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.89 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.1 ttt-85 -83.56 -31.89 26.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.959 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -35.43 81.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.39 -40.13 85.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.99 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.701 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.78 -50.95 54.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 5.7 ttp180 -66.15 -26.9 67.64 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.12 179.306 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -71.69 -48.93 44.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.408 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.644 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.5 -43.02 73.98 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.089 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -43.3 90.17 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.664 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.409 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -57.27 -42.26 81.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.866 178.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -59.32 -36.81 76.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.157 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.88 HG22 HD22 ' A' ' 58' ' ' LEU . 46.2 t -60.24 -46.68 94.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.315 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -57.6 -41.48 81.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.153 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.0 -31.77 70.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.603 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.5 mt -97.18 6.03 49.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.406 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.663 ' O ' HG22 ' A' ' 17' ' ' ILE . 37.5 mm -145.32 67.78 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 121.721 0.772 . . . . 0.0 110.029 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.64 -33.81 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.927 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.48 165.8 13.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.654 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -101.65 -32.97 10.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.985 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.19 74.37 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.419 ' HB2' HG23 ' A' ' 17' ' ' ILE . 5.1 mt-10 -50.77 -34.57 27.8 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 36.5 mttt -72.91 -34.82 66.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.897 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -63.78 -42.69 97.71 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.227 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.838 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 t80 -64.83 -45.16 87.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' HG21 ' A' ' 49' ' ' VAL . 7.9 mt -60.66 -38.98 86.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.501 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.7 m-85 -61.34 -44.63 96.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.588 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.68 -33.96 77.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.597 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.838 HG23 ' O ' ' A' ' 25' ' ' TYR . 42.3 t -65.52 -47.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.796 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.021 HD21 HD11 ' A' ' 62' ' ' ILE . 6.2 mt -61.84 -42.71 99.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.661 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.18 -40.87 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.493 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -47.02 86.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.144 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.78 ' CD2' HD22 ' B' ' 101' ' ' LEU . 4.9 t80 -55.58 -46.45 77.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.875 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -74.9 -33.63 62.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.578 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -77.3 -55.05 5.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.9 p -89.51 -10.82 44.83 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.444 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.8 mmt 59.63 24.51 13.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.731 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.76 ' HB3' HG23 ' A' ' 41' ' ' VAL . 5.1 m-20 -101.09 117.44 35.03 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.975 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.817 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.3 t -79.86 -21.93 11.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.009 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.61 -28.43 56.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.766 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.76 HG23 ' HB3' ' A' ' 38' ' ' ASP . 43.7 t -73.46 -44.19 54.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.759 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 46' ' ' LEU . 2.4 pp -68.4 -38.39 81.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.74 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.817 HG23 ' O ' ' A' ' 39' ' ' VAL . 91.5 t -63.95 -42.28 95.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.336 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.81 -58.36 14.63 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.165 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.403 ' CB ' HG22 ' A' ' 29' ' ' VAL . 6.2 m-20 -60.54 -40.17 90.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.975 0.417 . . . . 0.0 110.709 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 42' ' ' LEU . 12.3 mt -51.9 -43.19 63.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.608 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HD3' ' CZ ' ' A' ' 59' ' ' PHE . 1.6 tppt? -57.9 -47.48 82.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.14 0.495 . . . . 0.0 110.514 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.25 -36.39 63.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.71 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.566 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.9 p -101.22 2.25 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.553 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.908 HG23 ' O ' ' A' ' 55' ' ' ARG . 53.4 mt -140.15 29.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-O 121.29 0.566 . . . . 0.0 110.869 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.473 ' N ' ' O ' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -87.24 17.59 4.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.966 -179.869 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.407 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 3.5 mt-10 -128.36 142.2 43.9 Favored Pre-proline 0 CA--C 1.523 -0.07 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.54 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.575 ' HA ' HD12 ' A' ' 56' ' ' LEU . 81.8 Cg_exo -46.75 -38.26 22.38 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.148 1.899 . . . . 0.0 111.498 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -35.66 76.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.583 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.908 ' O ' HG23 ' A' ' 50' ' ' ILE . 18.9 mtt85 -90.83 -7.22 52.91 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.808 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 53' ' ' PRO . 13.3 mt -57.15 -46.02 99.88 Favored Pre-proline 0 CA--C 1.531 0.244 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.49 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 91.2 Cg_exo -43.77 -26.76 1.33 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.766 2.31 . . . . 0.0 113.729 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.88 HD22 HG22 ' A' ' 13' ' ' VAL . 8.5 mt -73.44 -30.29 63.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.757 0.313 . . . . 0.0 111.015 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.615 ' CE2' HG22 ' A' ' 78' ' ' THR . 0.1 OUTLIER -60.99 -48.45 81.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.618 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.442 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.9 OUTLIER -75.19 -31.0 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.77 179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.483 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.73 -58.2 9.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.776 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 1.021 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.92 -36.85 77.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.957 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.436 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 1.1 ttp85 -36.5 -62.82 0.49 Allowed Pre-proline 0 N--CA 1.469 0.489 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.454 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.6 Cg_exo -33.97 -36.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.406 2.737 . . . . 0.0 113.545 -179.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.723 HD11 HG21 ' B' ' 104' ' ' VAL . 15.2 mt -65.09 -56.8 10.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.413 0.625 . . . . 0.0 109.951 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.457 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -44.24 133.65 4.4 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.187 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -50.94 165.34 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.607 2.205 . . . . 0.0 112.437 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.98 -55.38 33.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.05 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.626 ' O ' HG12 ' A' ' 72' ' ' VAL . 19.1 tttm -57.52 -53.97 52.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.178 0.513 . . . . 0.0 110.342 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.537 ' CG ' HG21 ' A' ' 39' ' ' VAL . 44.5 m170 -60.99 -22.22 64.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.482 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.11 -54.93 16.78 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.974 0.416 . . . . 0.0 110.454 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.4 p -59.18 -35.11 55.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.183 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -68.47 -37.37 80.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.968 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 78' ' ' THR . 9.5 t80 -63.34 -37.91 89.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.216 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.21 -43.46 86.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.621 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -66.61 -26.67 67.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.22 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.6 mt -86.96 -25.68 24.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.933 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.918 HG23 ' O ' ' A' ' 74' ' ' TYR . 66.7 p -55.28 -45.27 99.88 Favored Pre-proline 0 CA--C 1.534 0.337 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' A' ' 78' ' ' THR . 23.2 Cg_endo -60.58 162.41 18.09 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.928 1.752 . . . . 0.0 112.257 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.911 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m 61.68 29.29 18.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.8 0.334 . . . . 0.0 111.074 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.627 HD21 ' CB ' ' A' ' 2' ' ' ASP . 10.9 mt -90.29 -29.05 18.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.972 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.78 HD22 ' CD2' ' A' ' 33' ' ' TYR . 53.2 tp -51.77 -52.76 46.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.459 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -57.15 -31.57 65.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.595 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.22 -40.26 95.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.723 HG21 HD11 ' A' ' 65' ' ' LEU . 2.0 t -70.94 -36.17 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.929 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.574 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.3 OUTLIER -72.0 -45.51 60.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.847 0.356 . . . . 0.0 110.484 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -70.06 -33.82 72.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.774 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -64.74 -45.36 86.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.756 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -50.66 45.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.735 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.529 HD23 ' HE3' ' B' ' 112' ' ' LYS . 55.2 mt -51.06 -40.68 58.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.472 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -77.46 -35.72 53.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.273 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -21.98 51.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.136 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 112' ' ' LYS . . . . . 0.529 ' HE3' HD23 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -100.98 -29.73 12.03 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.029 179.384 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.6 mttp . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.917 179.976 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.7 mtp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.795 0.331 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.626 ' HB3' HD21 ' B' ' 100' ' ' LEU . 0.3 OUTLIER 61.12 110.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.877 -179.851 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.7 mtt85 -160.96 -43.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.975 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -33.58 71.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.514 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.04 -39.3 71.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.1 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.987 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.09 -50.91 60.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -64.91 -26.9 68.51 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.188 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -70.61 -49.12 51.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.526 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.81 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.75 -43.57 72.0 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.083 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.899 ' CZ ' HD13 ' B' ' 111' ' ' LEU . 0.1 OUTLIER -58.93 -41.82 88.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.736 178.488 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -58.7 -42.3 88.27 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.784 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -59.91 -36.0 76.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.01 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 9' ' ' PHE . 45.0 t -60.5 -49.09 85.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.519 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -57.63 -38.74 75.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.308 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.95 -35.3 76.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.421 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 17' ' ' ILE . 74.2 mt -95.25 5.44 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.46 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.585 ' O ' HG22 ' A' ' 17' ' ' ILE . 40.5 mm -147.61 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 121.611 0.719 . . . . 0.0 110.224 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -56.42 -39.72 73.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.891 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.17 179.17 0.15 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.681 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -111.44 -32.26 6.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.2 -53.02 62.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.538 ' HB2' HG23 ' A' ' 17' ' ' ILE . 37.5 mt-10 -50.81 -35.04 30.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 7.2 mttt -73.25 -34.26 65.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.904 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.48 -41.27 98.57 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.638 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -65.08 -46.07 82.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.218 179.33 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.429 HD22 HG11 ' A' ' 13' ' ' VAL . 5.1 tp -60.55 -36.6 78.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.65 ' HA ' HD12 ' A' ' 30' ' ' LEU . 21.8 m-85 -62.83 -44.86 95.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.615 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.2 -40.55 90.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.548 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 25' ' ' TYR . 22.2 t -60.29 -47.88 90.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.921 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.846 HD21 HD11 ' A' ' 62' ' ' ILE . 4.8 mt -59.87 -44.71 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.45 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -32.99 69.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.348 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.445 ' O ' ' N ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -64.48 -55.36 21.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.283 179.563 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.485 ' HB3' HD21 ' B' ' 101' ' ' LEU . 0.1 OUTLIER -53.45 -34.45 57.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -74.85 -53.38 9.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.523 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.27 -55.18 5.64 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' MET . 17.8 p -86.67 -47.64 8.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.658 0.266 . . . . 0.0 111.583 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 75.45 32.41 0.72 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.863 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.709 ' O ' HD12 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -101.24 120.19 39.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.749 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.915 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.3 t -78.22 -16.54 13.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.252 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -36.55 53.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.99 0.424 . . . . 0.0 110.327 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 38' ' ' ASP . 26.3 t -72.81 -34.17 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.018 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.709 HD12 ' O ' ' A' ' 38' ' ' ASP . 0.2 OUTLIER -67.9 -44.31 77.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.89 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.915 HG23 ' O ' ' A' ' 39' ' ' VAL . 59.5 t -57.46 -40.0 72.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.816 0.341 . . . . 0.0 110.925 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.49 -57.68 10.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.757 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.46 ' HB3' HG22 ' A' ' 29' ' ' VAL . 2.1 m-20 -63.61 -48.91 75.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.999 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HG ' HG11 ' A' ' 29' ' ' VAL . 51.2 mt -50.48 -44.45 55.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.016 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.39 -46.64 89.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.094 0.473 . . . . 0.0 110.463 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mt -51.98 -37.63 53.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.699 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.584 HG13 HG13 ' A' ' 50' ' ' ILE . 14.8 p -101.11 1.74 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.454 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.868 HG23 ' O ' ' A' ' 55' ' ' ARG . 58.3 mt -135.13 27.41 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.304 0.573 . . . . 0.0 111.136 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 2.4 m120 -84.39 12.08 7.4 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.885 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -126.29 145.41 52.53 Favored Pre-proline 0 C--O 1.231 0.11 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.767 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.425 ' HA ' HD12 ' A' ' 56' ' ' LEU . 71.9 Cg_exo -47.95 -38.81 31.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.318 2.012 . . . . 0.0 111.692 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 p -69.27 -35.94 76.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.545 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.868 ' O ' HG23 ' A' ' 50' ' ' ILE . 63.3 mtt85 -88.02 -8.55 55.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.636 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.636 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 16.6 mt -55.43 -53.48 61.71 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.531 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.636 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.2 Cg_exo -39.04 -29.19 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.362 2.708 . . . . 0.0 113.641 -179.417 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.714 HD12 HG12 ' A' ' 50' ' ' ILE . 35.7 mt -60.94 -37.03 80.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -44.1 97.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.585 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.447 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.9 m-20 -75.0 -31.18 61.34 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.647 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.81 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.82 -62.31 1.73 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.752 -179.486 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.846 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.84 -35.06 71.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.055 -179.173 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.479 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 5.8 ttt-85 -38.05 -65.32 0.38 Allowed Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 76.7 Cg_exo -36.16 -33.7 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 123.084 2.523 . . . . 0.0 113.406 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.607 HD11 ' CE2' ' A' ' 9' ' ' PHE . 16.5 mt -65.14 -51.68 59.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.349 0.595 . . . . 0.0 110.128 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.522 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -45.08 132.15 5.47 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.351 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.472 ' HG2' ' HB2' ' A' ' 70' ' ' HIS . 2.8 Cg_endo -48.25 165.68 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.61 2.206 . . . . 0.0 112.123 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.1 tp -55.39 -56.12 23.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.419 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.1 pttt -56.3 -52.62 63.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.522 ' CB ' HG23 ' A' ' 66' ' ' ILE . 25.0 m170 -62.88 -29.19 70.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.477 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.03 -43.88 87.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.016 0.436 . . . . 0.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 t -67.85 -47.76 78.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.269 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.81 -27.9 69.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.508 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.816 ' O ' HG23 ' A' ' 78' ' ' THR . 23.0 t80 -69.37 -48.32 61.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.694 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -60.99 -39.01 88.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.631 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -61.97 -47.28 85.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.776 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 23.3 mt -68.02 -34.8 77.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.955 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.816 HG23 ' O ' ' A' ' 74' ' ' TYR . 68.4 p -74.36 154.48 88.02 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.932 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.407 ' HD2' ' HB ' ' A' ' 78' ' ' THR . 34.9 Cg_endo -64.65 98.35 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.475 2.117 . . . . 0.0 112.323 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.848 179.995 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 112.548 -0.221 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -125.92 30.68 5.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.771 0.32 . . . . 0.0 110.937 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' A' ' 2' ' ' ASP . 6.3 mt -131.54 -40.84 1.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.187 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.513 ' HA ' HD13 ' A' ' 65' ' ' LEU . 40.5 tp -51.92 -52.62 48.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.99 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.424 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.0 OUTLIER -54.99 -35.35 64.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.923 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.04 -38.57 91.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.987 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.1 t -69.8 -34.24 59.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.102 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.492 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.1 mt -64.44 -45.61 86.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.957 0.408 . . . . 0.0 109.959 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -35.19 80.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.566 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -62.63 -39.15 92.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.575 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.453 ' CE2' ' HG3' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -71.05 -52.9 16.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.737 179.767 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' B' ' 109' ' ' LEU . 11.6 mt -51.02 -35.7 35.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.769 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -76.89 -36.22 56.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.175 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.899 HD13 ' CZ ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -71.03 -10.66 60.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.293 178.934 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 27.5 mmtt -79.48 -54.28 6.07 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.02 0.438 . . . . 0.0 110.762 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.963 179.913 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.98 0.419 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 3' ' ' ARG . 3.7 m-20 -142.91 149.84 39.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.821 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 2' ' ' ASP . 0.9 OUTLIER 68.76 -57.22 0.51 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.643 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -34.75 72.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.811 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.42 -37.58 80.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.025 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.04 -49.84 53.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.717 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -26.71 68.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.335 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -70.06 -49.31 52.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.449 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.608 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -69.86 -42.54 73.38 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.951 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.618 ' NH2' HD22 ' B' ' 111' ' ' LEU . 22.1 ttp85 -57.47 -44.1 84.6 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.664 178.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -57.8 -43.33 85.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.209 0.528 . . . . 0.0 109.789 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -59.18 -35.23 73.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.193 179.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.806 HG22 HD23 ' A' ' 58' ' ' LEU . 61.5 t -62.05 -46.65 96.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.271 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -57.59 -39.3 76.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.005 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -69.07 -36.1 77.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.541 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.401 HD13 ' HG2' ' A' ' 57' ' ' PRO . 14.6 mt -96.49 8.39 44.21 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.572 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.666 ' O ' HG22 ' A' ' 17' ' ' ILE . 34.5 mm -150.06 69.53 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-O 121.625 0.726 . . . . 0.0 109.986 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.85 -33.52 70.53 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.03 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -60.89 175.47 0.49 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -110.26 -30.44 7.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.71 -51.23 63.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.973 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' A' ' 17' ' ' ILE . 35.1 mt-10 -50.78 -34.69 28.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 73.4 mttt -72.14 -35.5 69.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.003 178.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.45 -40.66 97.35 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.049 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.304 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.589 HD12 HG21 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.71 -38.62 78.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.56 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 14.1 m-30 -64.73 -45.43 86.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.7 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.74 -38.04 89.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.886 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 25' ' ' TYR . 36.3 t -63.0 -50.71 78.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.016 0.436 . . . . 0.0 110.952 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.96 HD21 HD11 ' A' ' 62' ' ' ILE . 13.0 mt -62.71 -40.41 97.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.483 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -65.36 -40.55 93.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.4 tpt -62.21 -44.85 95.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.371 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.711 ' CD2' HD13 ' B' ' 101' ' ' LEU . 6.3 t80 -57.45 -45.09 85.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.017 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -74.59 -33.67 62.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -55.0 5.8 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.25 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -82.33 -19.8 38.63 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 3.7 mmt 63.36 26.82 15.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.883 0.373 . . . . 0.0 110.652 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -114.06 121.39 43.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.81 ' O ' HG23 ' A' ' 43' ' ' VAL . 22.0 t -78.38 -16.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.238 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.78 54.79 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.915 0.388 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.53 -43.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.793 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.672 HD12 HD12 ' A' ' 46' ' ' LEU . 3.4 pp -69.01 -38.28 79.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.629 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 39' ' ' VAL . 79.5 t -61.56 -44.34 98.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.942 0.401 . . . . 0.0 110.377 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.31 -58.89 11.69 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.243 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.569 ' HA ' HD12 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -60.55 -39.32 87.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.819 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.771 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.0 mt -52.35 -45.02 65.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -57.36 -48.63 78.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.337 179.469 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.569 HD12 ' HA ' ' A' ' 45' ' ' ASP . 0.9 OUTLIER -51.07 -39.46 56.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.873 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 49' ' ' VAL . 10.9 p -100.94 4.93 10.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.42 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.871 HG23 ' O ' ' A' ' 55' ' ' ARG . 62.3 mt -138.34 27.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.257 0.551 . . . . 0.0 110.868 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 47' ' ' LYS . 2.2 m120 -84.69 12.59 6.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.835 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -125.37 148.31 60.71 Favored Pre-proline 0 C--N 1.334 -0.083 0 C-N-CA 121.13 -0.228 . . . . 0.0 110.552 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.491 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.79 -38.14 66.77 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.37 2.047 . . . . 0.0 111.466 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.6 p -69.54 -32.7 71.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.47 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.871 ' O ' HG23 ' A' ' 50' ' ' ILE . 86.2 mtt180 -90.57 -11.46 39.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.572 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.5 mt -55.97 -45.91 99.83 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.675 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.486 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.9 Cg_exo -44.32 -24.88 1.1 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.786 2.324 . . . . 0.0 113.532 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.806 HD23 HG22 ' A' ' 13' ' ' VAL . 6.9 mt -73.12 -35.35 66.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.747 0.308 . . . . 0.0 110.984 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -59.06 -46.04 89.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 0.0 110.751 179.92 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.433 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.3 m-20 -75.04 -30.95 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.85 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.582 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -64.96 -63.39 1.12 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.984 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.96 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -59.03 -37.42 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.457 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.7 mtm180 -38.45 -66.39 0.31 Allowed Pre-proline 0 N--CA 1.468 0.444 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 79.3 Cg_exo -37.05 -30.69 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.214 2.609 . . . . 0.0 113.54 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.608 HD11 ' CE2' ' A' ' 9' ' ' PHE . 16.2 mt -65.18 -49.82 68.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.524 0.678 . . . . 0.0 109.651 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.537 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -53.07 138.42 46.12 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.744 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -48.34 165.46 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.691 2.26 . . . . 0.0 112.427 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.435 ' O ' HG23 ' A' ' 72' ' ' VAL . 3.6 tp -56.93 -57.11 13.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.967 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -57.13 -53.59 56.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.129 0.49 . . . . 0.0 110.251 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.537 ' CB ' HG23 ' A' ' 66' ' ' ILE . 24.1 m170 -59.21 -28.73 66.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.451 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.31 -42.23 93.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 68' ' ' LEU . 23.3 t -62.89 -42.78 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.497 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.519 ' HG2' HD11 ' A' ' 77' ' ' LEU . 25.6 tt0 -64.46 -45.68 86.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.341 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.645 ' CD2' HG22 ' A' ' 43' ' ' VAL . 8.5 t80 -59.77 -44.71 93.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.375 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.569 ' O ' ' HD3' ' A' ' 79' ' ' PRO . 0.1 OUTLIER -60.28 -46.61 89.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.824 179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -67.13 -21.85 65.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.661 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.519 HD11 ' HG2' ' A' ' 73' ' ' GLU . 13.8 mt -84.53 -29.65 25.76 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.56 ' OG1' ' HD3' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -58.33 -49.35 94.06 Favored Pre-proline 0 N--CA 1.465 0.322 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.607 -178.762 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.569 ' HD3' ' O ' ' A' ' 75' ' ' ASP . 69.5 Cg_endo -94.35 -166.41 0.13 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.986 2.457 . . . . 0.0 112.697 -179.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.54 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 6.2 m -64.02 128.56 36.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.834 0.35 . . . . 0.0 110.972 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.7 mt -129.37 -44.19 1.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.999 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.711 HD13 ' CD2' ' A' ' 33' ' ' TYR . 2.6 pt? -51.81 -43.84 63.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.848 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.458 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 8.6 tttp -59.34 -33.91 71.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.382 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -68.1 -36.45 79.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.56 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.025 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.9 t -68.37 -34.15 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.868 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -68.4 -45.55 72.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.423 179.451 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.32 -39.87 92.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -61.7 -40.15 94.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.648 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.437 ' CD2' ' HG3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.14 -47.07 47.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.75 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 9.8 mt -51.31 -40.07 58.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.874 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -76.73 -37.35 56.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.569 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.618 HD22 ' NH2' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -73.69 -6.1 44.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.721 179.197 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -94.28 -77.61 0.46 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.968 0.413 . . . . 0.0 110.955 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.864 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.517 ' HA ' HG23 ' A' ' 5' ' ' VAL . 40.1 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.875 0.369 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.781 ' O ' HD23 ' B' ' 100' ' ' LEU . 3.9 p-10 -126.17 -44.28 1.75 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.965 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -120.08 -37.6 3.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.998 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.4 -37.97 79.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.008 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.517 HG23 ' HA ' ' A' ' 1' ' ' MET . 24.8 t -58.07 -42.5 83.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.208 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.048 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -65.33 -50.95 63.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.995 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -26.79 69.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.315 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -70.12 -49.11 54.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.591 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.73 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.4 -42.67 71.35 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 179.012 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' HD3' ' CE2' ' B' ' 108' ' ' TYR . 6.8 tmm_? -58.44 -42.04 86.47 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.656 178.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -59.06 -46.15 88.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.453 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.412 ' HG2' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -60.38 -31.72 70.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.403 179.611 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.799 HG22 ' CD2' ' A' ' 58' ' ' LEU . 47.6 t -63.64 -48.05 88.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.36 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.62 -41.31 81.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -69.15 -35.23 76.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.315 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.2 mt -93.38 6.95 46.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.525 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.673 ' O ' HG22 ' A' ' 17' ' ' ILE . 39.1 mm -142.31 66.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-O 121.782 0.801 . . . . 0.0 109.98 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -51.43 -31.57 23.5 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.044 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.73 170.66 11.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.719 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.01 -30.13 9.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.95 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.96 -50.26 72.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.014 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.4 ' HB2' HG23 ' A' ' 17' ' ' ILE . 8.6 mt-10 -50.72 -34.59 27.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.36 0.6 . . . . 0.0 109.397 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 33.6 mttt -71.75 -35.59 70.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.935 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.49 -42.55 99.57 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.19 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.879 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -64.72 -44.6 89.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.403 179.491 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.676 HD12 HG21 ' A' ' 49' ' ' VAL . 0.5 OUTLIER -59.52 -36.51 76.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.711 179.637 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 12.8 m-30 -64.19 -48.52 75.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.617 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.32 -38.64 80.8 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.784 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.879 HG23 ' O ' ' A' ' 25' ' ' TYR . 11.5 t -60.86 -52.54 60.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.08 0.467 . . . . 0.0 110.793 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.702 HD21 HD11 ' A' ' 62' ' ' ILE . 28.5 mt -59.58 -42.97 93.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.317 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.98 -36.71 70.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.474 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 1.8 mmt -63.56 -48.37 77.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.105 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.623 ' HB3' HD21 ' B' ' 101' ' ' LEU . 0.1 OUTLIER -53.39 -39.44 64.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.0 179.634 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.443 ' HD2' HD23 ' B' ' 101' ' ' LEU . 1.0 OUTLIER -74.85 -46.13 38.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.84 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.474 ' HG2' ' HA ' ' A' ' 32' ' ' MET . 1.2 pt20 -77.54 -52.68 8.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -178.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.4 p -92.78 -31.76 14.92 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.521 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 4.7 mmt 63.77 31.19 14.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.979 0.419 . . . . 0.0 110.79 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD2' ' HB3' ' A' ' 40' ' ' ALA . 2.2 t70 -104.87 118.51 36.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.917 ' O ' HG23 ' A' ' 43' ' ' VAL . 20.6 t -77.95 -14.61 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.463 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.455 ' HB3' ' OD2' ' A' ' 38' ' ' ASP . . . -76.07 -34.07 59.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 110.324 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.3 t -72.61 -37.76 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.203 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.541 ' O ' HD12 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -65.24 -44.41 88.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.937 179.684 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.917 HG23 ' O ' ' A' ' 39' ' ' VAL . 56.5 t -54.56 -43.66 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-O 120.796 0.332 . . . . 0.0 111.2 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.38 -56.41 15.64 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.688 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.507 ' HB3' HG22 ' A' ' 29' ' ' VAL . 1.8 m-20 -59.43 -52.19 66.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.866 0.365 . . . . 0.0 111.1 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.663 HD23 ' CD1' ' A' ' 50' ' ' ILE . 0.7 OUTLIER -50.42 -45.01 55.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.073 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.47 ' O ' ' N ' ' A' ' 51' ' ' ASN . 6.0 mttp -57.62 -48.39 79.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.118 0.485 . . . . 0.0 110.704 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 45' ' ' ASP . 10.8 mt -54.1 -37.56 64.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.676 HG21 HD12 ' A' ' 26' ' ' LEU . 10.4 p -101.04 3.47 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.332 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.902 HG23 ' O ' ' A' ' 55' ' ' ARG . 61.4 mt -139.18 27.86 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-O 121.305 0.574 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.47 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -88.6 16.86 6.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.72 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.414 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 18.9 mm-40 -128.94 142.87 46.59 Favored Pre-proline 0 C--N 1.335 -0.046 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.579 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 56' ' ' LEU . 87.1 Cg_exo -45.68 -39.16 17.88 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.254 1.97 . . . . 0.0 111.927 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -69.12 -34.84 75.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.719 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.902 ' O ' HG23 ' A' ' 50' ' ' ILE . 46.8 mtt85 -91.78 -9.71 42.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.91 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.491 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.5 mt -55.28 -46.12 99.74 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.651 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.47 -25.69 2.34 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.78 2.32 . . . . 0.0 113.523 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.799 ' CD2' HG22 ' A' ' 13' ' ' VAL . 3.4 mt -73.81 -34.15 64.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.85 0.357 . . . . 0.0 111.03 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.603 ' HE2' HG22 ' A' ' 78' ' ' THR . 0.2 OUTLIER -59.93 -50.86 72.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.436 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 5.0 t0 -75.2 -31.16 60.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.73 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.85 -53.67 54.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.052 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.702 HD11 HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -66.15 -36.78 78.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.906 0.384 . . . . 0.0 111.75 -179.571 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.402 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -35.51 -61.24 0.54 Allowed Pre-proline 0 N--CA 1.469 0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.294 -179.234 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.436 ' CD ' ' O ' ' A' ' 60' ' ' ASP . 75.8 Cg_exo -34.75 -33.98 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.511 2.807 . . . . 0.0 113.467 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.503 HD11 HG21 ' B' ' 104' ' ' VAL . 15.1 mt -65.2 -53.97 36.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.596 0.712 . . . . 0.0 109.525 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -46.41 136.64 7.13 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.135 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -67.18 165.7 25.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.448 2.098 . . . . 0.0 112.028 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 72' ' ' VAL . 3.9 tp -51.13 -50.37 59.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.174 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -58.43 8.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.919 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.547 ' HB2' HG23 ' A' ' 66' ' ' ILE . 18.2 m170 -62.05 -25.79 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.397 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.28 -42.33 99.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.017 0.437 . . . . 0.0 110.047 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 68' ' ' LEU . 35.1 t -67.74 -44.74 85.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.424 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -67.22 -33.76 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.932 ' O ' HG23 ' A' ' 78' ' ' THR . 50.8 t80 -64.89 -39.29 93.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.328 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -67.87 -42.32 81.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.797 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -66.76 -27.32 67.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.349 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.3 mt -86.61 -25.86 24.71 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.932 HG23 ' O ' ' A' ' 74' ' ' TYR . 71.7 p -55.51 -45.11 99.92 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.654 ' HD2' ' N ' ' A' ' 78' ' ' THR . 18.5 Cg_endo -58.62 164.19 9.75 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 121.979 1.786 . . . . 0.0 112.325 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.94 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 19.3 m -91.16 -26.33 19.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.768 0.318 . . . . 0.0 110.958 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.781 HD23 ' O ' ' A' ' 2' ' ' ASP . 0.7 OUTLIER -55.28 -29.84 58.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.05 -179.885 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.623 HD21 ' HB3' ' A' ' 33' ' ' TYR . 3.3 tp -56.18 -52.62 63.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.986 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.479 ' HA ' HD21 ' B' ' 105' ' ' LEU . 18.2 tttp -63.07 -31.56 72.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.24 -44.66 91.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.323 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.048 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.7 t -66.08 -54.2 29.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.227 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.674 HD12 ' N ' ' B' ' 106' ' ' GLU . 4.4 pp -61.75 -32.88 73.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 106' ' ' GLU . . . . . 0.674 ' N ' HD12 ' B' ' 105' ' ' LEU . 46.3 tt0 -73.96 -40.35 63.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.717 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -61.36 -35.64 78.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.443 ' CE2' ' HD3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -74.23 -51.09 16.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.2 0.524 . . . . 0.0 110.492 179.632 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' B' ' 109' ' ' LEU . 32.7 mt -51.16 -37.5 46.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.459 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 110' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' B' ' 111' ' ' LEU . 2.1 ptp180 -76.98 -35.69 56.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.197 179.184 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.419 ' N ' ' HG3' ' B' ' 110' ' ' ARG . 0.1 OUTLIER -64.06 -16.96 62.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.063 178.867 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 10.5 mmmt -100.26 -39.72 7.89 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.838 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.822 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.823 0.344 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -100.22 137.41 38.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.967 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.66 -35.11 7.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.78 -34.24 71.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.765 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -66.44 -35.1 74.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.75 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.99 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -70.01 -50.26 43.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.975 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -26.78 68.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.249 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.53 -49.11 51.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.389 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.66 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -69.55 -43.99 71.82 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.058 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.668 HH21 HG11 ' A' ' 13' ' ' VAL . 5.1 tpm_? -59.07 -40.82 86.38 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.581 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -59.33 -42.49 91.58 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.831 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.6 mttp -60.39 -37.23 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.272 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.795 HG13 HD22 ' A' ' 58' ' ' LEU . 41.9 t -59.9 -48.93 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -57.62 -39.07 76.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.219 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -69.05 -32.45 71.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.481 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.0 mt -100.42 8.53 43.54 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.529 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.693 ' O ' HG22 ' A' ' 17' ' ' ILE . 35.3 mm -147.02 68.52 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.702 0.763 . . . . 0.0 110.051 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -58.78 -33.37 70.24 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.891 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -72.72 139.15 47.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.742 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -75.46 -28.87 59.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.033 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -52.65 64.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.032 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.604 ' HB2' HG23 ' A' ' 17' ' ' ILE . 25.7 mt-10 -50.98 -34.76 30.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 17.7 mttp -72.21 -34.25 68.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.887 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -61.61 -41.8 97.98 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.188 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.906 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -67.76 -42.08 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.291 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.5 mt -63.1 -39.01 93.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.532 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.401 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.7 m-85 -62.67 -44.48 96.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.63 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -63.5 -44.51 94.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.547 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 25' ' ' TYR . 21.6 t -59.46 -46.49 92.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.07 HD21 HD11 ' A' ' 62' ' ' ILE . 3.8 mt -59.7 -44.41 93.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.426 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.86 -36.24 72.07 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.508 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.428 ' O ' ' N ' ' A' ' 36' ' ' THR . 25.8 mtp -63.35 -48.94 75.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.139 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.454 ' CE2' HG13 ' A' ' 66' ' ' ILE . 0.1 OUTLIER -53.54 -42.55 67.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.878 0.37 . . . . 0.0 110.883 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -44.55 49.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.869 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -77.34 -55.01 5.76 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.428 ' N ' ' O ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -92.2 -43.39 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -178.666 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.442 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.5 ttt 74.51 32.98 0.88 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.853 0.359 . . . . 0.0 110.652 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.707 ' O ' HD12 ' A' ' 42' ' ' LEU . 9.9 p30 -98.14 115.92 29.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.555 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.895 ' O ' HG23 ' A' ' 43' ' ' VAL . 20.8 t -79.2 -16.63 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.447 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.88 -37.68 47.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.017 0.437 . . . . 0.0 110.478 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.533 HG21 ' OD2' ' A' ' 38' ' ' ASP . 25.4 t -73.56 -34.06 40.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.279 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.707 HD12 ' O ' ' A' ' 38' ' ' ASP . 0.2 OUTLIER -69.51 -41.37 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.803 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 39' ' ' VAL . 95.0 t -60.0 -40.06 82.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.639 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.17 -57.27 12.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.449 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.55 -48.66 76.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.871 0.367 . . . . 0.0 110.908 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.56 ' HG ' HG11 ' A' ' 29' ' ' VAL . 65.6 mt -50.52 -41.93 54.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.874 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -62.15 -44.94 95.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.105 0.478 . . . . 0.0 110.435 179.621 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -54.95 -37.05 65.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.76 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.693 HG13 HG13 ' A' ' 50' ' ' ILE . 15.0 p -101.12 -0.78 10.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.394 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.882 HG23 ' O ' ' A' ' 55' ' ' ARG . 49.0 mt -136.64 29.46 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.083 0.468 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -89.31 16.53 7.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.674 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -131.01 143.7 50.52 Favored Pre-proline 0 C--N 1.333 -0.112 0 CA-C-O 120.561 0.22 . . . . 0.0 110.435 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.521 ' HA ' HD12 ' A' ' 56' ' ' LEU . 86.7 Cg_exo -46.25 -39.49 21.19 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.343 2.029 . . . . 0.0 111.974 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 m -69.21 -33.55 73.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.624 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.882 ' O ' HG23 ' A' ' 50' ' ' ILE . 11.2 mtp180 -89.87 -12.04 40.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.477 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.8 mt -53.78 -46.07 98.56 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 94.1 Cg_exo -43.72 -27.21 1.44 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.706 2.271 . . . . 0.0 113.736 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.795 HD22 HG13 ' A' ' 13' ' ' VAL . 14.9 mt -73.72 -34.23 64.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 111.139 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.72 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -65.96 -45.84 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 110.888 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.32 -31.48 60.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.832 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.536 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.35 -63.06 1.35 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.732 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 1.07 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.71 -30.86 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.971 0.415 . . . . 0.0 111.648 -179.619 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.498 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 25.1 ttp180 -40.18 -60.26 1.54 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.498 ' CD ' ' HB3' ' A' ' 63' ' ' ARG . 6.7 Cg_endo -48.76 -25.64 8.5 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.69 2.26 . . . . 0.0 113.28 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.66 HD11 ' CE2' ' A' ' 9' ' ' PHE . 26.1 mt -65.57 -45.25 84.02 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.568 0.699 . . . . 0.0 109.575 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.637 HG23 ' HB2' ' A' ' 70' ' ' HIS . 1.3 mp -50.7 136.43 25.65 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.149 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -61.39 165.78 12.47 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.576 2.184 . . . . 0.0 112.188 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.511 ' O ' HG23 ' A' ' 72' ' ' VAL . 16.8 mt -52.01 -49.76 62.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.467 -179.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -56.75 -61.35 2.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.162 0.506 . . . . 0.0 110.681 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.637 ' HB2' HG23 ' A' ' 66' ' ' ILE . 16.0 m170 -60.23 -26.66 66.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -60.81 -46.95 88.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.041 0.448 . . . . 0.0 109.896 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 68' ' ' LEU . 20.0 t -62.23 -45.0 99.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.935 179.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.12 -31.35 72.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.32 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.718 ' O ' HG23 ' A' ' 78' ' ' THR . 4.2 t80 -63.06 -46.34 87.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.67 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.18 -42.07 96.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.672 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -59.92 -35.38 74.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.726 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.555 HD13 HG21 ' A' ' 43' ' ' VAL . 6.4 mt -85.7 -32.79 21.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.01 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.718 HG23 ' O ' ' A' ' 74' ' ' TYR . 36.9 p -89.63 112.07 49.64 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.964 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.94 120.44 7.91 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.465 2.11 . . . . 0.0 112.189 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.857 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.24 -174.02 2.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.656 0.265 . . . . 0.0 110.914 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.411 HD22 ' CD2' ' A' ' 65' ' ' LEU . 2.7 mt 68.7 -61.06 0.42 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.253 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 26.3 tp -53.35 -52.75 58.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.959 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -56.68 -31.66 64.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -67.63 -38.41 83.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.977 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.99 HG22 ' HB1' ' A' ' 6' ' ' ALA . 23.9 t -70.85 -34.93 57.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.482 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.552 ' O ' HD12 ' B' ' 109' ' ' LEU . 0.5 OUTLIER -67.26 -45.62 76.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.425 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -73.61 -33.71 64.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.726 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -58.7 -50.09 75.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.794 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -44.47 46.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.693 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.582 HD23 ' HE2' ' B' ' 112' ' ' LYS . 4.9 mt -51.43 -41.68 60.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.57 -40.8 41.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.009 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.23 -20.06 38.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.567 179.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 112' ' ' LYS . . . . . 0.582 ' HE2' HD23 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -101.16 -23.37 14.46 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.204 179.629 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 113' ' ' LYS . . . . . 0.414 ' N ' ' HD2' ' B' ' 112' ' ' LYS . 10.9 mttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.19 -0.909 . . . . 0.0 110.915 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 ttm . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.793 0.33 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -110.07 31.26 6.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.932 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.7 -30.71 26.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.907 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -59.28 -33.52 71.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.9 t -61.61 -39.19 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.0 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.52 -50.96 56.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.183 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -66.68 -26.88 67.25 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.069 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -71.63 -48.93 44.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.372 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.918 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.32 -44.04 72.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.016 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.492 ' CZ ' HD22 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -59.47 -41.13 89.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.838 178.673 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -58.46 -43.0 88.69 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.8 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -60.7 -35.47 76.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 1.056 HG13 HD21 ' A' ' 58' ' ' LEU . 54.8 t -60.71 -48.46 88.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.465 179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.62 -41.33 81.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.191 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -69.14 -32.61 72.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.472 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.7 mt -97.99 7.47 46.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.547 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.658 ' O ' HG22 ' A' ' 17' ' ' ILE . 35.6 mm -146.59 68.63 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.931 0 CA-C-O 121.671 0.748 . . . . 0.0 109.861 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -55.92 -33.48 64.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.871 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -71.25 159.63 34.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.695 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.0 -29.78 15.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.975 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.54 -52.67 64.55 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.551 ' HB2' HG23 ' A' ' 17' ' ' ILE . 12.5 mt-10 -50.8 -34.77 28.93 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -72.88 -34.17 66.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.944 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -64.88 -44.67 88.92 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.249 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.883 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.8 -40.18 94.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.249 179.371 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.603 HD11 HD22 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -64.12 -39.73 94.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.492 179.595 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -60.89 -43.57 98.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.481 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -64.81 -36.29 83.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.547 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 25' ' ' TYR . 28.0 t -65.62 -45.41 92.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.019 HD21 HD11 ' A' ' 62' ' ' ILE . 12.9 mt -65.52 -43.3 90.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.522 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -63.63 -31.11 72.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.42 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -52.1 35.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.378 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.565 ' CG ' HD12 ' A' ' 42' ' ' LEU . 14.8 t80 -57.55 -33.88 68.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.996 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -74.57 -41.6 60.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.994 0.426 . . . . 0.0 111.018 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -77.45 -54.99 5.76 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.38 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 p -81.67 -28.79 33.37 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.518 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.0 mmt 64.13 35.46 10.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 110.607 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -118.21 124.23 47.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.883 ' O ' HG23 ' A' ' 43' ' ' VAL . 4.7 t -77.63 -7.37 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.377 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -38.56 47.99 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.05 0.453 . . . . 0.0 110.269 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.25 -33.98 60.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.99 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.89 HD22 HD11 ' A' ' 46' ' ' LEU . 1.2 mt -66.82 -49.77 64.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.884 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 39' ' ' VAL . 29.0 t -58.68 -42.87 86.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.477 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.35 -58.29 14.1 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.848 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -66.13 -40.9 91.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.258 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.89 HD11 HD22 ' A' ' 42' ' ' LEU . 20.7 mt -51.51 -47.44 63.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.096 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.48 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.76 -46.84 77.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 0.0 110.702 179.685 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.6 mt -53.57 -41.18 66.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.841 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.634 HG13 HG13 ' A' ' 50' ' ' ILE . 14.3 p -101.19 8.44 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.354 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.862 HG23 ' O ' ' A' ' 55' ' ' ARG . 71.2 mt -144.88 28.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.236 0.541 . . . . 0.0 111.094 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 47' ' ' LYS . 14.5 p30 -90.18 15.32 10.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.559 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -128.79 150.86 76.13 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.07 -39.21 70.75 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.38 2.053 . . . . 0.0 111.558 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.6 p -69.58 -34.01 73.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.806 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.862 ' O ' HG23 ' A' ' 50' ' ' ILE . 45.6 mtt180 -90.22 -12.21 38.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.69 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.485 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -53.03 -46.33 97.7 Favored Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 83.4 Cg_exo -46.65 -24.92 3.17 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.806 2.337 . . . . 0.0 113.56 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.056 HD21 HG13 ' A' ' 13' ' ' VAL . 27.8 mt -67.23 -35.3 79.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.709 0.29 . . . . 0.0 111.189 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -45.01 95.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.519 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.43 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 1.3 t0 -75.2 -31.12 60.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.848 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.918 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.25 -54.69 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.093 -179.326 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 1.019 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -71.19 -38.1 69.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.747 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.581 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 2.0 tmm_? -36.94 -55.76 1.55 Allowed Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.581 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 81.5 Cg_exo -41.16 -34.23 1.55 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.766 2.31 . . . . 0.0 112.958 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.596 HD12 HG13 ' A' ' 62' ' ' ILE . 24.3 mt -65.31 -51.28 61.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.391 0.615 . . . . 0.0 110.338 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.497 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -44.78 134.75 4.84 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.186 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.17 165.55 1.33 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.636 2.224 . . . . 0.0 112.361 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.7 tp -55.8 -55.51 31.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.952 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.07 -53.61 56.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.034 0.445 . . . . 0.0 110.403 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.497 ' CB ' HG23 ' A' ' 66' ' ' ILE . 19.2 m170 -59.62 -31.02 69.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.324 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -45.64 92.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.3 179.469 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.6 t -61.53 -47.76 91.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.096 179.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.09 -29.19 69.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.199 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.62 ' OH ' HD13 ' A' ' 46' ' ' LEU . 16.7 t80 -60.87 -52.02 66.81 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.651 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -62.47 -43.22 99.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.602 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -59.59 -29.72 68.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.884 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.5 mt -85.65 -37.7 19.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.855 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.56 HG22 ' O ' ' A' ' 74' ' ' TYR . 1.3 t -127.62 109.67 20.74 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.811 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.05 137.16 17.06 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.508 2.138 . . . . 0.0 112.575 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.0 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.466 -0.254 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 21.4 m -72.77 64.89 0.68 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 110.859 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mt -77.07 -51.11 11.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.865 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.813 HD11 HD23 ' A' ' 30' ' ' LEU . 11.7 tp -54.43 -52.85 60.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.827 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -57.75 -31.63 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.036 179.745 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.55 -41.02 93.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.145 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.0 HG22 ' HB1' ' A' ' 6' ' ' ALA . 25.8 t -70.47 -36.12 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.505 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.516 HD22 ' HB3' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -62.57 -45.65 91.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.91 0.386 . . . . 0.0 110.214 179.45 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -33.82 71.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.752 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -58.54 -43.45 89.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.879 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.45 ' CE2' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.04 -49.69 27.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.764 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 19.2 mt -51.14 -38.32 51.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.721 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 7.0 mtm-85 -76.91 -36.95 56.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.431 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.492 HD22 ' CZ ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -65.27 -14.83 61.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.319 178.971 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -93.07 -48.97 6.24 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.986 0.422 . . . . 0.0 110.855 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 5.8 mtmt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.865 -179.979 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 120.849 0.357 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.428 ' O ' ' CB ' ' A' ' 3' ' ' ARG . 16.8 p30 -164.2 148.78 9.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.819 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.428 ' CB ' ' O ' ' A' ' 2' ' ' ASP . 0.3 OUTLIER 82.41 -42.89 0.13 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.541 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -59.05 -45.15 91.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.833 0.349 . . . . 0.0 111.029 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -58.98 -40.77 81.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.109 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.53 -49.03 58.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.878 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -66.11 -26.76 67.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.111 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -71.06 -49.12 48.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.375 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.724 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.25 -44.39 72.04 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.083 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.45 85.16 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -57.63 -42.43 83.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.561 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -59.98 -36.78 77.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.911 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.998 HG22 HD22 ' A' ' 58' ' ' LEU . 48.8 t -58.56 -49.73 81.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.219 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -57.68 -38.25 74.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -68.93 -39.14 79.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.469 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.466 ' O ' HD13 ' A' ' 17' ' ' ILE . 16.3 mt -93.02 7.44 44.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.434 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.644 ' O ' HG22 ' A' ' 17' ' ' ILE . 42.4 mm -148.11 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.621 0.724 . . . . 0.0 110.141 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.85 -35.65 69.09 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.951 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.97 174.36 1.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -107.49 -33.29 7.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.935 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -51.48 69.24 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.986 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.411 ' HB2' HG23 ' A' ' 17' ' ' ILE . 19.6 mt-10 -50.8 -34.82 29.14 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.448 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 4.8 mttm -71.8 -34.61 69.52 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.97 178.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.45 -44.47 96.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.169 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.829 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -64.94 -41.71 95.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.357 179.429 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.58 -42.76 93.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.495 ' CE1' ' CG ' ' B' ' 108' ' ' TYR . 15.8 m-85 -61.46 -44.44 97.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.521 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.42 -32.92 72.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.846 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.966 HG12 HD23 ' A' ' 42' ' ' LEU . 21.5 t -66.07 -51.83 55.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.905 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.045 HD21 HD11 ' A' ' 62' ' ' ILE . 32.2 mt -62.05 -36.2 80.91 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.47 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -62.35 -38.81 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.385 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.437 ' O ' HG23 ' A' ' 36' ' ' THR . 10.3 mmm -65.19 -48.04 74.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.54 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.487 ' CD1' HD12 ' A' ' 42' ' ' LEU . 11.0 t80 -57.35 -33.67 68.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -70.1 -52.61 22.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.219 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -77.46 -54.96 5.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.918 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 32' ' ' MET . 5.5 p -66.87 -38.72 86.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.893 -179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.423 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.1 mmt 64.67 28.87 13.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.84 0.352 . . . . 0.0 110.716 -179.364 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.16 127.13 53.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.866 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.8 t -75.26 -7.55 10.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.168 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.9 -36.47 56.64 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.008 0.432 . . . . 0.0 110.199 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.82 -33.97 54.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.966 HD23 HG12 ' A' ' 29' ' ' VAL . 2.3 mt -67.27 -47.77 69.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.833 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 39' ' ' VAL . 31.3 t -57.72 -45.65 86.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.555 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.84 -57.39 17.71 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.049 -179.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.801 ' HB3' HG22 ' A' ' 29' ' ' VAL . 9.0 m-20 -64.88 -42.93 94.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.705 0.288 . . . . 0.0 111.28 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.715 HD11 HD22 ' A' ' 42' ' ' LEU . 26.9 mt -50.42 -53.29 30.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.5 mttt -53.18 -48.36 68.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.873 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.9 mt -49.96 -42.95 49.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.083 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.9 p -101.09 5.72 10.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.427 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.861 HG23 ' O ' ' A' ' 55' ' ' ARG . 41.6 mt -138.19 28.39 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.329 0.585 . . . . 0.0 110.941 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 1.8 m120 -84.84 13.68 5.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.907 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -126.31 143.03 44.55 Favored Pre-proline 0 N--CA 1.457 -0.085 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.633 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 56' ' ' LEU . 83.2 Cg_exo -46.86 -38.92 23.93 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.281 1.987 . . . . 0.0 111.801 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.4 t -69.3 -32.82 72.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.582 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.861 ' O ' HG23 ' A' ' 50' ' ' ILE . 91.5 mtt180 -90.12 -12.69 37.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.547 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.495 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.5 mt -54.42 -45.98 99.2 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.495 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 98.7 Cg_exo -44.2 -30.9 3.78 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.788 2.325 . . . . 0.0 113.69 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.998 HD22 HG22 ' A' ' 13' ' ' VAL . 16.7 mt -64.6 -39.86 94.47 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.686 0.279 . . . . 0.0 111.272 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.467 ' HE1' HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -54.5 -47.26 73.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.006 0.432 . . . . 0.0 110.627 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -75.31 -31.26 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.715 179.475 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.724 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -61.81 -57.02 13.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.907 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 1.045 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.52 -37.41 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.043 -179.177 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.442 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.3 mtp85 -36.44 -64.58 0.36 Allowed Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 73.7 Cg_exo -36.49 -33.85 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.234 2.623 . . . . 0.0 113.221 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.676 HD12 HG13 ' A' ' 62' ' ' ILE . 24.4 mt -65.13 -51.28 62.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.447 0.641 . . . . 0.0 110.117 179.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.506 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -45.37 135.32 5.62 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.304 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.16 165.67 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.667 2.244 . . . . 0.0 112.336 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.4 mt -56.03 -57.06 13.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.117 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.466 ' O ' HG12 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -59.68 -46.58 88.63 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.706 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.506 ' CB ' HG23 ' A' ' 66' ' ' ILE . 23.2 m170 -65.37 -25.48 67.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.476 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.46 -55.03 35.71 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.569 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.5 p -62.83 -37.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.385 179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.523 ' OE2' HD11 ' A' ' 77' ' ' LEU . 0.5 OUTLIER -70.2 -31.69 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.362 179.318 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.804 ' O ' HG22 ' A' ' 78' ' ' THR . 11.4 t80 -64.08 -47.82 78.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.477 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -62.95 -43.11 99.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.586 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -59.92 -33.5 71.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.683 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.523 HD11 ' OE2' ' A' ' 73' ' ' GLU . 28.4 mt -73.67 -35.45 65.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.901 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.804 HG22 ' O ' ' A' ' 74' ' ' TYR . 0.5 OUTLIER -106.99 103.47 47.83 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -80.95 -168.25 0.61 Allowed 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.744 2.296 . . . . 0.0 112.352 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.8 mmm-85 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.849 179.825 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 77.3 p -156.0 -45.89 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.999 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp -88.5 -35.24 17.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.88 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.661 HD12 HD13 ' A' ' 65' ' ' LEU . 21.9 tp -53.99 -52.59 60.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.797 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -31.7 67.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.704 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.32 -38.81 91.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.883 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.109 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.1 t -69.66 -41.54 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.059 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.2 mt -57.61 -44.17 85.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.29 0.567 . . . . 0.0 109.909 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -73.66 -32.81 64.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.955 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 107' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' B' ' 110' ' ' ARG . 18.1 m-20 -57.3 -50.4 73.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.929 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' B' ' 105' ' ' LEU . 4.2 p90 -79.99 -33.92 38.98 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.244 -0.583 . . . . 0.0 109.997 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.471 ' HG ' ' CE1' ' B' ' 108' ' ' TYR . 12.6 mt -60.54 -36.64 78.92 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 110' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' B' ' 107' ' ' ASP . 0.2 OUTLIER -77.21 -36.27 54.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.275 179.381 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' B' ' 111' ' ' LEU . 9.0 mt -76.69 -6.27 51.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.402 178.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 112' ' ' LYS . . . . . 0.448 ' HE3' ' CD2' ' A' ' 27' ' ' TYR . 0.1 OUTLIER -74.73 -78.41 0.1 Allowed 'General case' 0 N--CA 1.458 -0.069 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.852 -179.939 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.224 -0.894 . . . . 0.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.852 0.358 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.83 72.43 10.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.942 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -178.42 -38.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.95 -42.79 99.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.813 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.21 -35.07 59.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.077 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.94 -51.05 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.004 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.28 -26.88 67.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.198 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.74 -45.97 60.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.456 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -70.7 -44.76 66.3 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.67 -42.77 89.25 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.15 -40.28 89.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.937 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -62.28 -36.27 81.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.06 179.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.711 HG22 HD22 ' A' ' 58' ' ' LEU . 47.2 t -59.41 -52.06 65.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.228 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -57.47 -35.22 69.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.167 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -69.01 -39.8 79.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.599 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 mt -98.12 11.17 38.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.557 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.66 ' O ' HG22 ' A' ' 17' ' ' ILE . 36.0 mm -149.44 69.12 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-O 121.692 0.758 . . . . 0.0 110.143 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -60.42 -36.77 78.95 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.739 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -62.08 140.28 58.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.704 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.88 -36.61 56.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.36 65.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.852 0.358 . . . . 0.0 111.16 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.537 ' HB2' HG23 ' A' ' 17' ' ' ILE . 47.3 mt-10 -50.68 -34.75 27.85 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.417 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 9.9 mtpt -73.26 -35.34 66.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.847 178.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.09 -39.22 94.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.007 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.884 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -68.0 -43.41 78.94 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.311 179.366 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -62.87 -45.46 92.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.677 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.4 m-85 -60.93 -37.06 80.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.675 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.78 -32.99 73.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.592 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 25' ' ' TYR . 21.5 t -72.0 -39.45 66.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.837 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.665 HD21 HD11 ' A' ' 62' ' ' ILE . 16.5 mt -69.89 -40.71 75.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.535 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -37.27 81.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.333 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.32 -46.03 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.13 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.735 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.4 t80 -60.15 -35.66 75.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.437 ' CE1' ' HE3' ' B' ' 102' ' ' LYS . 42.2 t-80 -74.58 -44.67 49.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.326 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -77.51 -54.98 5.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.162 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.3 p -74.17 -23.09 59.18 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.007 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 18.7 mmt 61.24 22.25 12.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.676 0.274 . . . . 0.0 110.798 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.616 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -98.47 116.45 30.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.707 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.752 ' HA ' HD23 ' A' ' 42' ' ' LEU . 21.6 t -80.15 -21.41 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.187 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.2 -32.46 56.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.7 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.616 HG23 ' HB3' ' A' ' 38' ' ' ASP . 39.2 t -73.4 -42.32 56.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.801 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 39' ' ' VAL . 0.4 OUTLIER -69.11 -36.15 77.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.701 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 39' ' ' VAL . 54.1 t -66.81 -43.16 89.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.023 0.44 . . . . 0.0 110.338 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.39 -56.05 27.23 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.334 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -60.99 -42.26 98.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.94 0.4 . . . . 0.0 110.719 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.804 HD22 ' CD1' ' A' ' 50' ' ' ILE . 12.2 mt -50.44 -43.74 55.18 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.743 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.3 mmtt -56.69 -50.59 71.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.245 0.545 . . . . 0.0 110.58 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -38.5 54.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.912 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 49' ' ' VAL . 12.5 p -101.15 5.49 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.416 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.856 HG23 ' O ' ' A' ' 55' ' ' ARG . 69.2 mt -141.31 29.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.272 0.558 . . . . 0.0 110.826 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 47' ' ' LYS . 1.5 m120 -82.11 9.06 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.413 ' CG ' ' CD ' ' A' ' 55' ' ' ARG . 2.8 pt-20 -132.61 153.93 81.31 Favored Pre-proline 0 N--CA 1.462 0.157 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.367 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.482 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.8 Cg_endo -51.23 -38.25 61.05 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.836 2.357 . . . . 0.0 112.168 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -32.47 72.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.411 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.856 ' O ' HG23 ' A' ' 50' ' ' ILE . 14.8 mtp180 -94.47 -10.24 32.96 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.441 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.595 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.4 mt -54.13 -54.2 50.14 Favored Pre-proline 0 C--N 1.332 -0.161 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.595 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.6 Cg_endo -41.44 -24.89 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.123 2.549 . . . . 0.0 113.841 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.711 HD22 HG22 ' A' ' 13' ' ' VAL . 17.6 mt -73.74 -31.49 63.38 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.312 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.785 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -72.36 -41.29 66.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 110.963 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.444 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 3.3 m-20 -75.03 -30.92 61.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.654 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.826 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.81 -60.08 2.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.009 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.665 HD11 HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.06 -35.84 59.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.929 -179.452 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.436 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.2 ttt-85 -41.82 -65.64 0.49 Allowed Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.126 -179.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.464 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.1 Cg_exo -35.57 -30.75 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.337 2.691 . . . . 0.0 113.757 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.849 HD11 ' CE2' ' A' ' 9' ' ' PHE . 25.0 mt -64.94 -50.78 65.07 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.468 0.652 . . . . 0.0 109.784 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.564 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.6 mp -41.59 127.94 2.37 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.452 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.454 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 52.9 Cg_exo -55.21 165.8 2.75 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.66 2.24 . . . . 0.0 112.175 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.502 ' O ' HG23 ' A' ' 72' ' ' VAL . 1.5 mp -52.19 -50.18 62.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.287 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -57.74 -60.6 3.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.168 0.509 . . . . 0.0 110.39 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.564 ' CB ' HG23 ' A' ' 66' ' ' ILE . 44.7 m170 -58.76 -24.23 61.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.378 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -44.43 83.36 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.087 0.47 . . . . 0.0 109.82 179.075 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 68' ' ' LEU . 28.6 t -61.58 -42.96 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.736 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 -31.74 70.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.147 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.539 ' O ' HG22 ' A' ' 78' ' ' THR . 4.3 t80 -59.04 -48.62 80.94 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.546 179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -68.0 -38.56 82.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.751 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -57.23 -35.34 69.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.804 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 mt -84.38 -31.2 24.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.771 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 74' ' ' TYR . 1.4 t -137.1 113.12 9.61 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.754 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.41 166.24 26.22 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.46 2.107 . . . . 0.0 112.318 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.883 -179.955 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.542 -0.223 . . . . 0.0 112.542 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -107.9 83.87 1.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 110.965 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.508 ' O ' HG23 ' B' ' 104' ' ' VAL . 3.4 mt -107.99 -31.01 8.15 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.827 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.683 ' HA ' HD13 ' A' ' 65' ' ' LEU . 2.1 pt? -52.24 -41.84 63.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.813 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.511 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 20.9 tttt -60.32 -38.84 84.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -34.41 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.722 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 1.077 HG22 ' HB1' ' A' ' 6' ' ' ALA . 2.8 t -70.97 -34.79 56.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.496 HD23 ' N ' ' B' ' 105' ' ' LEU . 0.7 OUTLIER -66.67 -45.62 78.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.961 0.41 . . . . 0.0 110.065 179.195 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -69.87 -34.33 73.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.642 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.41 -48.25 81.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.23 -42.74 79.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.57 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 10.2 mt -51.18 -39.22 55.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.547 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 74.3 mtp180 -76.82 -34.96 57.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.09 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.0 -16.77 62.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.187 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -73.21 -73.94 0.19 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.816 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 4.9 mttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.895 179.96 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 mtt . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.779 0.324 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -177.01 57.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.74 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 53.0 mtm-85 -115.91 -34.44 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.157 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -59.3 -36.54 75.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.96 -39.78 78.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.212 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.27 -51.18 56.09 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.085 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.69 ' HD2' HD11 ' B' ' 111' ' ' LEU . 3.3 ttp-105 -65.77 -26.79 67.88 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.303 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -72.6 -48.74 37.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.47 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.808 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -68.86 -42.51 76.96 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.142 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.625 HH21 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -61.26 -42.77 99.19 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.893 178.749 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -56.85 -41.44 77.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.176 0.512 . . . . 0.0 109.674 178.863 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -60.48 -38.05 83.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.018 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 1.012 HG13 HD21 ' A' ' 58' ' ' LEU . 57.5 t -57.68 -50.06 78.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.469 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -57.72 -37.81 74.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.105 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.593 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.6 mt -97.43 8.83 43.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.528 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.634 ' O ' HG22 ' A' ' 17' ' ' ILE . 37.3 mm -148.96 69.13 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-O 121.619 0.723 . . . . 0.0 110.092 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -33.46 69.6 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.921 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.71 175.58 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.965 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -110.25 -29.76 8.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.959 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.53 -52.82 61.95 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.419 ' O ' HD12 ' A' ' 26' ' ' LEU . 6.4 mt-10 -50.84 -34.88 29.69 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 11.2 mttt -72.95 -34.14 66.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.86 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -62.38 -42.65 99.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.041 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.79 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -66.93 -40.93 87.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.281 179.422 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 22' ' ' GLU . 1.9 mt -61.46 -38.22 86.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.642 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 19.9 m-85 -65.48 -43.97 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.3 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.756 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 25' ' ' TYR . 17.0 t -65.1 -50.18 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.905 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.069 HD21 HD11 ' A' ' 62' ' ' ILE . 5.9 mt -63.83 -33.5 75.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.426 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -67.02 -41.6 86.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.66 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.83 -43.55 92.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.411 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 37' ' ' MET . 1.7 t80 -60.79 -38.41 85.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.841 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -74.88 -46.79 33.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.869 0.366 . . . . 0.0 111.323 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -77.73 -54.74 6.0 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.2 -34.71 12.13 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.496 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.1 mtt 72.74 32.03 1.53 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.808 0.337 . . . . 0.0 110.793 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.474 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -84.37 115.1 22.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.709 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.9 t -77.76 -23.71 14.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.8 -37.15 30.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 38' ' ' ASP . 24.8 t -73.55 -35.86 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.664 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.789 ' HA ' HG13 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -73.96 -38.92 64.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.014 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.775 HG22 ' CE1' ' A' ' 74' ' ' TYR . 75.7 t -69.82 -43.04 80.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.936 0.398 . . . . 0.0 110.521 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.77 -50.01 72.29 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.404 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.741 ' HA ' HD12 ' A' ' 48' ' ' LEU . 75.4 m-20 -62.95 -47.34 83.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.376 . . . . 0.0 110.933 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.786 ' HG ' HG11 ' A' ' 29' ' ' VAL . 20.4 mt -50.8 -42.33 58.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 4.2 mtpt -58.48 -51.73 68.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.48 . . . . 0.0 110.811 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.741 HD12 ' HA ' ' A' ' 45' ' ' ASP . 7.7 mt -53.04 -35.54 59.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.941 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.588 HG13 HG13 ' A' ' 50' ' ' ILE . 14.7 p -100.97 3.21 10.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.36 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.88 HG23 ' O ' ' A' ' 55' ' ' ARG . 54.7 mt -139.09 27.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.131 0.491 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -85.54 16.09 4.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.812 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -127.58 140.97 39.51 Favored Pre-proline 0 CA--C 1.523 -0.059 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.59 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HA ' HD12 ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.33 -38.88 15.78 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.378 2.052 . . . . 0.0 111.881 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 t -69.32 -34.76 75.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.716 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.88 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -89.72 -13.88 35.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.775 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.64 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 12.8 mt -49.0 -51.62 54.09 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.64 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 5.1 Cg_exo -39.97 -28.33 0.25 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.242 2.628 . . . . 0.0 113.893 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.012 HD21 HG13 ' A' ' 13' ' ' VAL . 9.3 mt -63.48 -38.58 91.7 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.644 0.259 . . . . 0.0 111.102 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.481 ' CE1' ' CZ ' ' A' ' 74' ' ' TYR . 0.2 OUTLIER -59.82 -44.0 94.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 0.0 110.674 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -75.1 -31.58 61.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.692 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.808 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.82 -60.25 3.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.391 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 1.069 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -66.93 -30.01 48.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.829 -179.645 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.474 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 16.1 ttp180 -40.21 -58.08 2.52 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.2 Cg_endo -48.48 -30.0 14.92 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.706 2.271 . . . . 0.0 113.125 -178.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.568 HD12 ' CG1' ' A' ' 62' ' ' ILE . 12.9 mt -65.37 -49.61 68.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.482 0.658 . . . . 0.0 109.872 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.484 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -47.12 133.73 9.08 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.159 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.33 165.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.488 2.125 . . . . 0.0 112.14 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.6 tp -56.46 -57.79 10.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.871 0.367 . . . . 0.0 110.928 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.7 pttt -58.97 -48.93 79.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.081 0.467 . . . . 0.0 110.429 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.484 ' CB ' HG23 ' A' ' 66' ' ' ILE . 38.3 m170 -60.73 -29.21 69.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.386 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.66 -42.3 91.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.059 0.457 . . . . 0.0 110.241 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 31.1 t -62.45 -45.35 98.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.362 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.33 -31.88 69.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.458 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.876 ' O ' HG22 ' A' ' 78' ' ' THR . 63.2 t80 -70.75 -41.0 72.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.731 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -37.68 83.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.74 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -66.47 -41.22 89.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.664 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 16.8 mt -68.18 -34.87 77.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.071 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.876 HG22 ' O ' ' A' ' 74' ' ' TYR . 5.1 t -93.07 125.49 54.66 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.972 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.08 -170.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.396 2.064 . . . . 0.0 112.294 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.022 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.541 -0.224 . . . . 0.0 112.541 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 13.5 m -101.95 105.95 16.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.825 0.345 . . . . 0.0 110.891 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.483 ' HB3' HD22 ' A' ' 65' ' ' LEU . 30.9 mt -83.76 -26.07 29.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.974 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.538 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.6 OUTLIER -51.76 -53.2 42.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.855 -179.842 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 pttt -61.2 -31.7 71.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.72 -40.39 94.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.945 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 104' ' ' VAL . . . . . 0.773 HG11 ' CZ ' ' A' ' 9' ' ' PHE . 2.4 t -71.16 -46.5 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.458 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 105' ' ' LEU . . . . . 0.624 HD21 ' HB3' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -65.08 -45.5 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.957 0.408 . . . . 0.0 110.478 179.845 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 106' ' ' GLU . . . . . 0.445 ' HA ' ' CD2' ' B' ' 109' ' ' LEU . 5.0 tt0 -66.03 -37.83 86.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.075 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -64.57 -36.37 84.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.34 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -76.29 -55.96 5.08 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.377 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.582 ' C ' HD12 ' B' ' 109' ' ' LEU . 2.7 pp -51.28 -34.97 35.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.488 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 110' ' ' ARG . . . . . 0.504 ' N ' HD12 ' B' ' 109' ' ' LEU . 17.2 mtt-85 -76.92 -36.43 56.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.917 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.69 HD11 ' HD2' ' A' ' 7' ' ' ARG . 10.9 mt -68.32 -12.44 61.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.429 178.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -70.64 -73.45 0.17 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.943 0.402 . . . . 0.0 110.876 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.881 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tpp85 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.863 0.363 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.03 -33.73 73.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.854 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.7 t -64.24 -35.58 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.076 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.71 -51.0 38.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.995 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.412 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.31 -26.84 68.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.229 179.313 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -70.76 -47.69 58.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.475 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.728 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.58 -44.53 67.18 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -43.87 77.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.736 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.412 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 9.6 m170 -60.13 -41.14 92.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.085 0.469 . . . . 0.0 109.952 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -61.22 -37.55 83.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.129 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.861 HG22 ' CD2' ' A' ' 58' ' ' LEU . 47.0 t -59.97 -49.13 85.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.392 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.66 -37.54 73.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.178 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -68.84 -37.12 78.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.699 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 mt -97.72 8.96 43.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.535 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 17' ' ' ILE . 36.7 mm -149.76 69.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-O 121.731 0.777 . . . . 0.0 110.112 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.803 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.83 160.72 16.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.724 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.73 -29.42 14.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.969 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.98 -53.64 54.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.517 ' HB2' HG23 ' A' ' 17' ' ' ILE . 11.0 mt-10 -50.91 -34.84 30.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.412 ' O ' ' CG ' ' A' ' 27' ' ' TYR . 8.2 mttm -73.52 -34.78 65.4 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.905 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -65.42 -43.8 89.36 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.15 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.897 ' O ' HG23 ' A' ' 29' ' ' VAL . 5.7 t80 -64.37 -41.3 96.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.205 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.37 -39.85 95.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.359 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.412 ' CG ' ' O ' ' A' ' 23' ' ' LYS . 20.6 m-85 -60.29 -43.8 95.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.495 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -64.66 -34.43 78.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.498 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 25' ' ' TYR . 17.5 t -67.82 -43.41 86.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.783 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.037 HD21 HD11 ' A' ' 62' ' ' ILE . 16.1 mt -66.12 -42.51 89.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.628 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -32.93 74.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.624 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.415 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 70.9 mmm -66.66 -47.06 73.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.583 ' CG ' HD12 ' A' ' 42' ' ' LEU . 13.3 t80 -59.37 -40.83 87.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.038 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.575 ' HD2' HD23 ' B' ' 101' ' ' LEU . 4.8 t-80 -67.86 -43.39 79.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.346 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.507 ' HG3' HG23 ' A' ' 36' ' ' THR . 19.4 pt20 -77.24 -50.0 13.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.901 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.507 HG23 ' HG3' ' A' ' 35' ' ' GLN . 22.3 p -78.08 -30.5 49.64 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.425 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.2 mmt 62.64 28.73 16.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.952 0.406 . . . . 0.0 110.718 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -119.53 122.31 41.35 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.88 ' O ' HG23 ' A' ' 43' ' ' VAL . 14.9 t -78.66 -7.27 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.537 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.0 -36.99 58.96 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.091 0.472 . . . . 0.0 110.22 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.95 -34.03 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.959 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.819 HD23 HG12 ' A' ' 29' ' ' VAL . 1.3 mt -65.52 -46.34 80.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.844 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 39' ' ' VAL . 33.4 t -57.54 -45.73 86.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.423 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.91 -58.0 15.91 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.772 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -64.67 -36.35 83.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.089 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.587 HD13 ' OH ' ' A' ' 74' ' ' TYR . 13.8 mt -52.89 -55.02 26.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.831 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -54.48 -43.35 71.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.767 179.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.98 -45.78 61.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.788 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 49' ' ' VAL . 13.4 p -100.98 8.42 8.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.342 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.766 ' O ' HG22 ' A' ' 50' ' ' ILE . 60.1 mt -138.51 27.11 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.33 0.586 . . . . 0.0 111.034 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.46 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -85.78 15.91 4.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.803 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -127.65 144.27 50.53 Favored Pre-proline 0 C--O 1.23 0.072 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.427 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.514 ' HA ' HD12 ' A' ' 56' ' ' LEU . 6.5 Cg_endo -48.7 -37.97 36.06 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.347 2.032 . . . . 0.0 111.513 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -69.38 -34.07 74.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.644 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.763 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -90.46 -12.45 37.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.79 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 53' ' ' PRO . 13.8 mt -52.51 -45.86 95.5 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.9 Cg_exo -47.01 -23.92 2.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.735 2.29 . . . . 0.0 113.595 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.861 ' CD2' HG22 ' A' ' 13' ' ' VAL . 12.4 mt -73.73 -37.63 65.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.736 0.303 . . . . 0.0 111.322 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.664 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -60.06 -48.83 80.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.908 0.385 . . . . 0.0 111.111 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.402 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -75.22 -30.99 60.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.994 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.728 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -63.73 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.283 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 1.037 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -59.93 -34.24 55.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -41.53 -63.12 0.89 Allowed Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.905 -178.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 87.0 Cg_exo -33.8 -33.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.338 2.692 . . . . 0.0 113.541 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.476 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.5 mt -64.91 -53.81 40.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.355 0.598 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.574 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -43.41 132.19 3.59 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.116 179.52 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.86 165.5 10.02 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.618 2.212 . . . . 0.0 112.019 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.442 ' O ' HG23 ' A' ' 72' ' ' VAL . 2.1 tt -51.99 -51.36 57.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.219 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -61.06 2.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 0.0 110.539 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.607 ' HB3' HG21 ' A' ' 39' ' ' VAL . 36.8 m170 -59.21 -23.66 62.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -43.43 86.94 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.116 0.484 . . . . 0.0 110.166 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 68' ' ' LEU . 27.2 t -64.85 -45.51 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.374 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -32.98 70.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.473 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.805 ' HB2' HG11 ' A' ' 39' ' ' VAL . 7.5 t80 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.539 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 10.6 mt . . . . . 0 C--O 1.232 0.175 0 CA-C-O 121.027 0.442 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.62 HD11 HD23 ' A' ' 30' ' ' LEU . 9.5 tp -55.32 -52.66 62.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.597 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.42 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.5 OUTLIER -56.75 -33.41 66.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.05 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.076 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.9 t -68.69 -36.53 74.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.257 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.471 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.8 OUTLIER -63.5 -45.62 89.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 110.294 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.7 -35.8 81.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.623 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.8 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.908 0.385 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.45 -33.55 73.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.825 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.0 t -61.42 -36.86 75.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.207 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.99 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.04 -51.16 41.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.105 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 3.2 ttt180 -67.17 -26.84 66.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.156 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -72.7 -45.99 55.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.289 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.691 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.76 -43.92 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -44.92 84.82 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.768 178.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.444 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 4.2 m-70 -58.91 -39.31 81.13 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.202 0.525 . . . . 0.0 109.743 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -62.47 -38.1 88.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.282 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.69 HG22 HD22 ' A' ' 58' ' ' LEU . 52.9 t -59.6 -48.21 88.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.512 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -57.59 -42.64 83.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.17 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -69.01 -33.56 73.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.617 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.43 ' O ' HD13 ' A' ' 17' ' ' ILE . 69.5 mt -95.4 6.44 49.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.651 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.645 HG22 ' O ' ' A' ' 17' ' ' ILE . 40.3 mm -147.12 68.35 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-O 121.657 0.741 . . . . 0.0 110.037 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.15 -35.75 67.51 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.921 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -63.46 174.89 1.14 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -109.3 -30.51 7.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.41 -51.88 66.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.487 ' OE1' HG23 ' A' ' 17' ' ' ILE . 12.6 mt-10 -50.88 -34.8 29.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.39 0.614 . . . . 0.0 109.42 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -72.4 -33.67 67.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.26 -43.08 95.97 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.147 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.87 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.3 t80 -64.56 -43.22 94.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.233 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.4 tp -59.09 -41.13 87.33 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.54 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -60.0 -47.92 83.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.76 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -59.09 -39.32 81.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.735 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 25' ' ' TYR . 5.1 t -63.87 -49.65 80.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.929 HD21 HD11 ' A' ' 62' ' ' ILE . 5.4 mt -62.17 -40.71 96.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.365 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -60.27 -34.53 73.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.398 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.63 ' SD ' HG11 ' A' ' 41' ' ' VAL . 4.2 mmt -66.08 -51.41 58.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.242 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.49 ' CG ' HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -53.53 -35.53 60.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.085 0.469 . . . . 0.0 110.543 179.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -55.64 5.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.84 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.69 -55.24 5.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.425 ' HG1' ' C ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -82.74 -36.17 25.99 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.461 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.3 mmt 64.77 23.93 12.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.02 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.596 ' OD2' HG23 ' A' ' 41' ' ' VAL . 29.4 t70 -100.59 114.74 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.333 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.895 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.5 t -73.01 -8.62 11.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.583 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.51 ' HB3' ' OD2' ' A' ' 38' ' ' ASP . . . -75.57 -34.26 60.67 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.072 0.463 . . . . 0.0 110.243 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.63 HG11 ' SD ' ' A' ' 32' ' ' MET . 29.0 t -73.62 -33.85 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.417 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.818 HD23 HG12 ' A' ' 29' ' ' VAL . 0.5 OUTLIER -69.18 -42.63 75.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.831 179.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 39' ' ' VAL . 46.7 t -58.06 -43.29 84.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.091 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.84 -56.17 15.95 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.78 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.463 ' CB ' HG22 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -63.08 -49.12 75.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.839 0.352 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HG ' HG11 ' A' ' 29' ' ' VAL . 68.5 mt -50.57 -48.0 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.086 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.77 -49.57 72.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.075 0.464 . . . . 0.0 110.634 179.776 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.429 HD13 ' OH ' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -51.85 -39.65 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.023 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 49' ' ' VAL . 12.4 p -101.46 7.28 9.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.445 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.798 HG23 ' O ' ' A' ' 55' ' ' ARG . 77.9 mt -143.15 28.06 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.257 0.551 . . . . 0.0 111.419 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.447 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.4 p30 -89.81 14.99 10.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.641 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -130.94 150.47 76.68 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.575 0.226 . . . . 0.0 110.607 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.504 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.5 Cg_endo -52.1 -38.6 70.78 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.402 2.068 . . . . 0.0 111.447 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.32 -33.23 72.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.367 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.798 ' O ' HG23 ' A' ' 50' ' ' ILE . 11.1 mtt85 -91.75 -5.88 52.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.573 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.6 mt -60.56 -44.8 96.58 Favored Pre-proline 0 CA--C 1.53 0.206 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.68 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 90.4 Cg_exo -43.48 -28.11 1.57 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.705 2.27 . . . . 0.0 113.421 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.69 HD22 HG22 ' A' ' 13' ' ' VAL . 16.0 mt -73.85 -33.91 64.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.902 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.591 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -61.28 -48.65 80.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.734 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.409 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.1 t0 -75.22 -31.0 60.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.651 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.691 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.71 -62.89 1.53 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.738 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.929 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.81 -31.78 53.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.724 -179.585 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.505 ' HA ' HD12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -37.15 -66.69 0.27 Allowed Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 112.327 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 76.8 Cg_exo -36.6 -32.39 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.092 2.528 . . . . 0.0 113.561 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.583 HD12 ' CG1' ' A' ' 62' ' ' ILE . 19.2 mt -65.67 -51.09 62.16 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.718 0.771 . . . . 0.0 109.439 179.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.505 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.9 mt -44.26 121.87 4.08 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.373 -1.285 . . . . 0.0 111.53 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.4 ' O ' ' N ' ' A' ' 71' ' ' GLN . 76.1 Cg_exo -47.84 165.75 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.832 2.355 . . . . 0.0 112.439 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.3 tt -55.51 -56.9 14.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.785 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -44.47 97.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.43 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 23.5 m170 -63.9 -29.3 70.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.288 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.418 ' HA ' HG21 ' A' ' 66' ' ' ILE . 1.4 mt-30 -61.51 -42.08 98.27 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.172 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.89 -46.26 89.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.09 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -65.01 -33.07 75.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.213 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.3 t80 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.512 179.641 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.419 ' O ' HG23 ' B' ' 104' ' ' VAL . 3.9 mt . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.787 0.327 . . . . 0.0 110.852 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 13.2 tp -54.45 -52.8 60.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.854 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 45.5 tttm -57.45 -31.52 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.835 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.98 -36.79 80.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.877 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.99 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.4 t -71.04 -37.19 66.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.475 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.8 OUTLIER -65.0 -45.57 85.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.006 0.431 . . . . 0.0 110.291 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -68.92 -34.63 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 179.716 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.827 0.346 . . . . 0.0 110.991 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.07 -40.3 89.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.947 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.7 t -60.45 -35.02 60.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.003 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.049 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.27 -50.95 42.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.182 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.64 -26.77 67.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -71.22 -48.98 48.11 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.688 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -70.04 -43.02 72.13 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -44.11 81.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.716 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 11.5 m170 -58.49 -42.68 88.13 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.2 -35.43 75.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.29 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.68 HG13 HD22 ' A' ' 58' ' ' LEU . 43.3 t -62.22 -49.03 85.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.616 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.63 -37.74 73.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.198 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -68.95 -30.11 68.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.456 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.404 ' O ' HD13 ' A' ' 17' ' ' ILE . 5.2 mt -105.35 10.18 33.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.611 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.74 HG23 ' HB2' ' A' ' 22' ' ' GLU . 37.3 mm -146.26 67.96 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 CA-C-O 121.679 0.752 . . . . 0.0 110.151 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -79.12 -26.18 42.9 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.023 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.2 OUTLIER -49.2 -25.14 2.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.551 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 19' ' ' ASN . 5.8 t0 82.76 -53.14 0.19 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.097 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.57 -50.06 68.89 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.74 ' HB2' HG23 ' A' ' 17' ' ' ILE . 21.9 mt-10 -50.86 -34.59 28.67 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -35.7 76.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.953 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.423 ' HA ' ' CD2' ' A' ' 27' ' ' TYR . 1.0 OUTLIER -62.23 -47.37 84.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.014 0.435 . . . . 0.0 110.187 179.467 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.906 ' O ' HG23 ' A' ' 29' ' ' VAL . 3.6 t80 -61.41 -39.33 90.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.328 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.636 HD22 HG11 ' A' ' 13' ' ' VAL . 0.2 OUTLIER -60.3 -40.99 92.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.497 179.583 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.423 ' CD2' ' HA ' ' A' ' 24' ' ' ASP . 11.6 m-85 -60.87 -46.82 89.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.408 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.43 -37.03 82.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.766 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 1.062 HG12 HD13 ' A' ' 42' ' ' LEU . 21.8 t -63.29 -44.64 99.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.807 HD21 HD11 ' A' ' 62' ' ' ILE . 7.0 mt -64.77 -46.41 82.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.509 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -32.33 72.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.46 ' HG2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -68.23 -45.72 72.48 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.454 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.652 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.3 t80 -59.47 -38.37 80.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.963 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -74.52 -44.9 49.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.826 0.346 . . . . 0.0 111.544 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -55.09 5.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 112.059 -179.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 p -74.71 -40.24 61.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.434 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.2 mtp 69.96 26.04 4.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.89 0.376 . . . . 0.0 110.7 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.46 124.66 53.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.645 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.889 ' O ' HG23 ' A' ' 43' ' ' VAL . 29.6 t -77.33 -10.36 13.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.207 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.72 -35.41 44.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.964 0.411 . . . . 0.0 110.61 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.46 HG11 ' HG2' ' A' ' 32' ' ' MET . 32.8 t -71.11 -34.3 54.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.236 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.062 HD13 HG12 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -70.0 -47.99 59.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.002 179.78 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 39' ' ' VAL . 46.9 t -57.44 -40.41 74.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.788 0.328 . . . . 0.0 111.039 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.93 -56.25 17.42 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.698 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.503 ' HB3' HG22 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.43 -48.61 77.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.838 0.351 . . . . 0.0 111.13 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.56 -46.93 57.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.147 -179.707 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.3 -52.33 64.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.792 179.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.92 -38.6 36.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.958 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.626 HG21 HD12 ' A' ' 26' ' ' LEU . 14.7 p -101.2 4.6 10.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.594 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.901 HG23 ' O ' ' A' ' 55' ' ' ARG . 58.2 mt -138.46 27.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 121.267 0.555 . . . . 0.0 111.161 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.435 ' N ' ' O ' ' A' ' 47' ' ' LYS . 34.3 m-20 -85.49 12.81 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.748 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.75 142.82 43.23 Favored Pre-proline 0 C--N 1.334 -0.071 0 O-C-N 122.3 -0.25 . . . . 0.0 110.674 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.441 ' HA ' HD12 ' A' ' 56' ' ' LEU . 88.5 Cg_exo -46.27 -38.87 20.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.288 1.992 . . . . 0.0 111.788 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -33.62 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.588 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.901 ' O ' HG23 ' A' ' 50' ' ' ILE . 40.8 mtt180 -90.75 -11.43 39.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.727 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.497 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -54.31 -45.35 99.28 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 88.0 Cg_exo -45.87 -24.76 2.28 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.853 2.369 . . . . 0.0 113.667 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.68 HD22 HG13 ' A' ' 13' ' ' VAL . 9.3 mt -72.92 -35.83 67.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.698 0.285 . . . . 0.0 110.919 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.402 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -58.01 -50.79 72.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.751 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.422 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 2.8 t0 -75.38 -31.26 60.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.809 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.469 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.9 -56.25 23.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.849 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.807 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -67.17 -32.54 58.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 111.559 -179.548 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.439 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.5 mtp180 -37.37 -63.72 0.47 Allowed Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.473 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.439 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 74.9 Cg_exo -36.9 -32.64 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.127 2.552 . . . . 0.0 113.617 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.532 HD11 ' CE2' ' A' ' 9' ' ' PHE . 14.1 mt -65.53 -50.75 64.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.624 0.726 . . . . 0.0 109.79 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.465 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -46.62 133.07 8.14 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.242 179.754 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -49.6 165.6 0.26 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.64 2.226 . . . . 0.0 112.284 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -57.87 10.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.855 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -50.02 75.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.039 0.447 . . . . 0.0 110.303 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.441 ' CB ' HG23 ' A' ' 66' ' ' ILE . 53.0 m170 -60.7 -27.59 68.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.374 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -65.35 -44.21 88.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.9 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 19.9 t -61.45 -43.54 96.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.326 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -66.51 -47.06 74.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.383 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.7 t80 . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.443 179.547 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.424 ' HB3' HD22 ' A' ' 65' ' ' LEU . 49.6 mt . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.759 0.314 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.505 HD23 ' H ' ' B' ' 101' ' ' LEU . 0.4 OUTLIER -54.03 -35.18 61.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.128 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.535 ' HA ' HD21 ' B' ' 105' ' ' LEU . 0.0 OUTLIER -68.6 -33.19 73.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.95 -38.23 76.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.049 HG22 ' HB1' ' A' ' 6' ' ' ALA . 39.0 t -71.01 -51.0 38.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.371 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.566 HD12 ' N ' ' B' ' 106' ' ' GLU . 3.8 pp -61.57 -33.48 73.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.573 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . 0.566 ' N ' HD12 ' B' ' 105' ' ' LEU . 6.6 tt0 -73.79 -38.77 64.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 0.0 110.257 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.591 179.501 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.756 0.312 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.95 -33.68 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.829 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.43 -35.92 74.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.018 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -70.22 -50.89 35.27 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.964 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -26.81 68.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.155 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -70.97 -48.98 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.357 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.77 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.04 -43.59 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.084 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.745 ' HD2' HG12 ' B' ' 104' ' ' VAL . 2.5 tpm_? -57.1 -44.94 83.7 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.712 178.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -57.83 -40.04 79.1 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.792 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.7 mtpt -62.82 -36.8 84.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.029 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.902 HG22 HD22 ' A' ' 58' ' ' LEU . 46.5 t -58.59 -48.99 84.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.285 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -57.58 -42.25 82.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.081 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -69.1 -34.62 75.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.523 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.433 ' O ' HD13 ' A' ' 17' ' ' ILE . 78.3 mt -95.12 7.34 46.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.595 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 17' ' ' ILE . 40.0 mm -148.27 68.69 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.73 0.776 . . . . 0.0 110.129 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -57.16 -36.13 70.38 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.97 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -64.55 169.18 5.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.695 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -102.54 -31.46 10.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.95 67.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.933 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.623 ' O ' HD12 ' A' ' 26' ' ' LEU . 22.5 mt-10 -50.77 -34.69 28.29 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 27.7 mttt -72.71 -35.19 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.939 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -62.86 -41.11 99.24 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.132 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.804 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -65.92 -45.75 80.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.298 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.623 HD12 ' O ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -60.36 -39.56 87.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.703 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.0 m-85 -61.82 -44.06 97.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.701 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -65.56 -40.98 93.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.648 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.804 HG23 ' O ' ' A' ' 25' ' ' TYR . 46.4 t -60.82 -53.25 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.063 0.459 . . . . 0.0 110.982 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.007 HD21 HD11 ' A' ' 62' ' ' ILE . 4.0 mt -59.98 -36.19 76.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.657 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -43.14 84.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.569 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -45.06 94.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.046 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.675 ' CE1' HG22 ' A' ' 39' ' ' VAL . 6.6 t80 -57.65 -48.17 80.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.781 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.71 ' HD2' HD23 ' B' ' 101' ' ' LEU . 1.8 t-80 -74.99 -33.66 61.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.873 0.368 . . . . 0.0 111.664 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -77.44 -54.98 5.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.7 p -93.98 -6.0 46.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.475 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.5 mmt 58.87 23.5 11.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.708 0.29 . . . . 0.0 110.96 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.419 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.5 t0 -98.22 116.72 31.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.915 0.388 . . . . 0.0 110.912 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.845 ' O ' HG23 ' A' ' 43' ' ' VAL . 27.8 t -82.52 -20.7 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.27 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.64 -28.1 55.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.804 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 38' ' ' ASP . 48.0 t -73.46 -43.77 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.782 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.5 pp -68.53 -39.21 81.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.753 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.845 HG23 ' O ' ' A' ' 39' ' ' VAL . 84.9 t -60.65 -40.71 85.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.853 0.358 . . . . 0.0 110.389 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.51 -59.13 9.23 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.26 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.474 ' CB ' HG22 ' A' ' 29' ' ' VAL . 12.4 m-20 -60.1 -44.2 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 110.771 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.773 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.7 mt -51.3 -44.13 61.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.73 -48.31 78.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.105 0.479 . . . . 0.0 110.627 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 mt -54.17 -37.53 64.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.824 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 49' ' ' VAL . 11.9 p -101.04 5.13 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.428 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.879 HG23 ' O ' ' A' ' 55' ' ' ARG . 65.7 mt -142.33 29.08 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-O 121.301 0.572 . . . . 0.0 110.72 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.7 p-10 -88.07 15.2 7.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.945 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.2 pt-20 -131.69 149.12 72.54 Favored Pre-proline 0 C--N 1.334 -0.098 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.765 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.603 ' HA ' HD12 ' A' ' 56' ' ' LEU . 7.2 Cg_endo -49.51 -38.51 44.47 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.697 2.265 . . . . 0.0 111.812 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.2 t -69.12 -33.93 74.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.609 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.879 ' O ' HG23 ' A' ' 50' ' ' ILE . 97.9 mtt180 -94.5 -5.28 46.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.685 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.603 HD12 ' HA ' ' A' ' 53' ' ' PRO . 12.2 mt -59.44 -45.24 98.91 Favored Pre-proline 0 CA--C 1.532 0.284 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 81.4 Cg_exo -42.94 -29.03 1.38 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.772 2.315 . . . . 0.0 113.475 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.902 HD22 HG22 ' A' ' 13' ' ' VAL . 14.4 mt -73.94 -32.29 63.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.741 0.305 . . . . 0.0 111.023 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.469 ' CD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -60.83 -50.02 75.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.095 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.407 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 22.5 t0 -75.21 -31.02 60.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.894 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.739 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.73 -60.26 4.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.95 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 1.007 HD11 HD21 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -59.3 -36.99 66.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.928 -179.534 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.475 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -36.32 -66.8 0.25 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.479 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.478 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 79.7 Cg_exo -36.14 -33.04 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.191 2.594 . . . . 0.0 113.342 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.657 HD11 ' CE2' ' A' ' 9' ' ' PHE . 22.7 mt -65.07 -51.93 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.0 109.875 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.427 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -47.22 136.73 8.74 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.032 179.622 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.25 165.61 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.483 2.122 . . . . 0.0 112.34 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 tp -57.09 -57.87 10.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.955 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -51.41 69.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.106 0.479 . . . . 0.0 110.345 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.427 ' CB ' HG23 ' A' ' 66' ' ' ILE . 31.5 m170 -59.91 -28.31 67.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.325 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.32 -44.31 95.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.086 0.469 . . . . 0.0 110.155 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.32 -47.35 93.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.345 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.45 -39.38 93.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.356 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.735 ' CE2' HG22 ' A' ' 43' ' ' VAL . 57.6 t80 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.691 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.656 ' O ' HG23 ' B' ' 104' ' ' VAL . 6.0 mt . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.824 0.345 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.812 HD11 HD23 ' A' ' 30' ' ' LEU . 13.9 tp -55.1 -52.86 61.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.093 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.6 -37.57 68.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.92 -36.54 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.719 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.018 HG22 ' HB1' ' A' ' 6' ' ' ALA . 2.1 t -71.09 -34.09 53.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.078 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -70.87 -45.72 63.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.973 0.416 . . . . 0.0 110.365 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.0 -39.74 87.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.903 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.753 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.784 0.326 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -65.58 -36.81 84.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.753 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.2 -35.13 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.912 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.006 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.63 -51.15 53.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.271 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.427 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -64.41 -26.95 68.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.245 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.8 -49.08 50.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.553 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -68.83 -43.29 75.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HG3' ' CG1' ' B' ' 104' ' ' VAL . 0.7 OUTLIER -61.96 -40.23 94.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.881 178.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.427 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 8.2 m170 -56.99 -41.37 78.28 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -60.96 -36.11 78.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.795 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.627 HG13 HD22 ' A' ' 58' ' ' LEU . 50.1 t -58.82 -48.7 85.38 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.105 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.17 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.7 -39.22 76.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.119 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -68.78 -31.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.465 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.3 mt -102.29 8.94 40.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.44 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 17' ' ' ILE . 31.3 mm -149.97 69.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 CA-C-O 121.677 0.751 . . . . 0.0 110.025 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -58.96 -33.84 71.11 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.899 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -63.46 160.8 15.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.801 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -97.64 -30.76 12.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.978 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.15 -52.95 61.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.007 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -50.95 -34.78 30.22 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.2 mttt -72.82 -34.3 66.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.766 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -61.77 -43.03 99.65 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -65.55 -45.54 83.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.289 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.7 tt -60.81 -40.81 94.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.455 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -59.26 -43.42 92.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -69.54 -37.34 77.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.813 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 25' ' ' TYR . 40.7 t -62.36 -52.33 61.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.876 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.017 HD21 HD11 ' A' ' 62' ' ' ILE . 41.2 mt -60.9 -41.12 95.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.667 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -40.22 87.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.268 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -45.62 87.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.971 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.561 ' CG ' HD22 ' A' ' 42' ' ' LEU . 4.9 t80 -55.58 -44.67 77.1 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.941 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -74.87 -34.42 62.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.556 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.47 -55.06 5.7 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.0 p -88.07 -14.62 38.43 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.447 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.8 mmt 61.37 23.6 13.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.739 0.304 . . . . 0.0 110.626 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -98.48 116.72 31.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.744 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.762 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.4 t -81.27 -20.77 10.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.281 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.09 -29.27 48.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.339 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.2 t -73.42 -42.88 56.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.79 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.749 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.1 pp -70.2 -39.73 75.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.744 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.762 HG23 ' O ' ' A' ' 39' ' ' VAL . 81.6 t -65.01 -37.36 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.938 0.399 . . . . 0.0 110.388 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.34 -56.68 18.59 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.137 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -64.72 -44.69 89.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.857 0.36 . . . . 0.0 110.774 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.874 ' HG ' HG11 ' A' ' 29' ' ' VAL . 13.7 mt -50.97 -41.07 59.15 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.688 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.48 -46.62 89.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.398 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.68 -34.49 65.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.563 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 49' ' ' VAL . 9.4 p -100.92 0.3 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.3 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.902 HG23 ' O ' ' A' ' 55' ' ' ARG . 50.8 mt -138.5 29.31 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.334 0.587 . . . . 0.0 110.939 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.483 ' N ' ' O ' ' A' ' 47' ' ' LYS . 20.7 p30 -87.53 16.77 5.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.787 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.7 mm-40 -127.35 143.57 47.7 Favored Pre-proline 0 C--N 1.334 -0.091 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.443 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.427 ' HA ' HD12 ' A' ' 56' ' ' LEU . 5.6 Cg_endo -47.83 -38.47 30.37 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.452 2.101 . . . . 0.0 111.518 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.33 -33.8 73.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.713 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.902 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.8 mtt180 -92.04 -10.32 39.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.885 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.493 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.9 mt -55.62 -44.7 99.79 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.733 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.3 Cg_exo -44.31 -26.77 1.73 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.661 2.24 . . . . 0.0 113.474 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.699 HD12 HG12 ' A' ' 50' ' ' ILE . 3.7 mt -73.69 -32.0 63.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.842 0.353 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.504 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -67.54 -40.78 85.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.81 179.864 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 18.2 t70 -75.37 -31.0 60.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.811 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.63 -56.84 6.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.864 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 1.017 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -61.27 -38.16 79.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.86 -179.239 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.444 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -39.69 -65.14 0.45 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.258 -179.002 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 70.6 Cg_exo -35.59 -32.91 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.261 2.641 . . . . 0.0 113.483 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.6 mt -65.07 -53.72 41.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 109.822 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.557 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.5 mp -42.26 128.15 2.8 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.306 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.79 165.69 1.09 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.791 2.328 . . . . 0.0 112.347 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -52.47 -53.6 43.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.031 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.539 ' O ' HG12 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -57.51 -54.65 44.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.682 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.557 ' CB ' HG23 ' A' ' 66' ' ' ILE . 27.2 m170 -63.11 -20.44 65.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.555 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -53.91 32.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.967 0.413 . . . . 0.0 110.244 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 69' ' ' LYS . 6.1 p -61.91 -37.17 77.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.161 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.68 -38.12 73.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.065 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.6 t80 . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.468 179.416 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.45 ' HB3' HD22 ' A' ' 65' ' ' LEU . 6.9 mt . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.74 0.305 . . . . 0.0 111.158 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.47 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -54.21 -40.55 67.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.993 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.553 ' HA ' HD21 ' B' ' 105' ' ' LEU . 0.6 OUTLIER -66.84 -31.99 72.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.86 -34.9 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.053 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.006 HG22 ' HB1' ' A' ' 6' ' ' ALA . 25.2 t -70.85 -55.19 14.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.342 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.587 HD12 ' N ' ' B' ' 106' ' ' GLU . 2.8 pp -58.6 -40.98 84.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.803 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . 0.587 ' N ' HD12 ' B' ' 105' ' ' LEU . 10.5 tt0 -73.7 -33.42 64.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.804 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.039 -179.992 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 120.678 0.275 . . . . 0.0 111.652 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.6 tttp -58.69 -33.4 70.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.9 0.381 . . . . 0.0 110.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 51.6 t -59.89 -38.66 77.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.804 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.71 -51.04 54.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.27 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.437 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -67.04 -26.88 66.97 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.108 179.392 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -72.64 -48.84 36.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.388 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.924 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -68.44 -42.86 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.47 ' CD ' HG12 ' B' ' 104' ' ' VAL . 2.1 tpt180 -58.26 -46.12 86.57 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.095 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.7 t-160 -56.54 -42.05 77.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -60.75 -35.92 77.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.292 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.673 HG22 HD22 ' A' ' 58' ' ' LEU . 60.5 t -60.67 -49.84 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.601 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -57.75 -39.34 77.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.501 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -69.12 -30.12 68.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.735 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.452 HD13 ' HG2' ' A' ' 57' ' ' PRO . 82.4 mt -96.43 -0.22 49.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.621 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.991 HD11 HD11 ' A' ' 58' ' ' LEU . 91.4 mt -143.95 69.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 CA-C-O 122.122 0.963 . . . . 0.0 110.374 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -76.07 -2.81 32.63 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.88 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -71.66 -23.54 61.69 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 t0 78.55 -55.83 0.47 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.19 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -51.91 57.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.857 0.36 . . . . 0.0 111.245 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.49 ' HB2' HG23 ' A' ' 17' ' ' ILE . 22.6 mt-10 -50.88 -34.75 29.52 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -71.02 -34.46 71.32 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.89 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -45.09 96.06 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.114 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.886 ' O ' HG23 ' A' ' 29' ' ' VAL . 10.6 t80 -64.57 -41.39 96.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.149 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.608 HD23 HG11 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -60.69 -36.57 79.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.533 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -64.6 -47.38 78.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.612 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.4 -37.22 86.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.594 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 25' ' ' TYR . 40.8 t -69.34 -36.39 71.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.608 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.974 HD21 HD11 ' A' ' 62' ' ' ILE . 14.0 mt -68.53 -43.95 75.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.54 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -36.75 84.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.382 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.76 ' CE ' HG21 ' A' ' 36' ' ' THR . 0.0 OUTLIER -63.97 -48.23 77.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.202 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.715 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.1 t80 -55.51 -43.06 75.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.992 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.561 ' HD2' HD23 ' B' ' 101' ' ' LEU . 34.0 t-80 -74.78 -38.45 62.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.782 -179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -55.08 5.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.76 HG21 ' CE ' ' A' ' 32' ' ' MET . 63.2 p -82.9 -13.81 55.38 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.432 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 20.5 mmt 60.45 21.18 10.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.768 0.318 . . . . 0.0 110.929 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.8 OUTLIER -94.52 113.11 24.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.857 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.8 t -82.12 -23.32 9.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.225 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.82 -28.8 58.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.986 0.422 . . . . 0.0 110.915 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.611 HG23 ' HB3' ' A' ' 38' ' ' ASP . 53.8 t -73.42 -43.93 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.841 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.715 HD22 ' CG ' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -69.23 -37.04 77.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.678 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 39' ' ' VAL . 71.7 t -62.09 -46.38 96.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.955 0.407 . . . . 0.0 110.144 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -58.42 -56.63 24.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.995 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.602 ' HA ' HD12 ' A' ' 48' ' ' LEU . 64.7 m-20 -60.6 -36.94 79.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 110.447 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.851 HD22 ' CD1' ' A' ' 50' ' ' ILE . 10.4 mt -52.45 -46.21 66.35 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.523 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.8 mptt -55.42 -46.38 76.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.543 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.602 HD12 ' HA ' ' A' ' 45' ' ' ASP . 5.1 mt -54.41 -39.47 67.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.641 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.608 HG11 HD23 ' A' ' 26' ' ' LEU . 14.4 p -101.13 8.61 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.272 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.851 ' CD1' HD22 ' A' ' 46' ' ' LEU . 88.3 mt -144.79 28.68 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 121.305 0.574 . . . . 0.0 110.666 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' ' O ' ' A' ' 47' ' ' LYS . 21.9 p-10 -86.21 10.35 14.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.219 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -133.4 155.97 80.21 Favored Pre-proline 0 C--N 1.334 -0.084 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.249 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.559 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.4 Cg_endo -52.29 -38.84 73.21 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.824 2.349 . . . . 0.0 112.086 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.75 -34.18 75.15 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.461 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.844 ' O ' HG23 ' A' ' 50' ' ' ILE . 87.1 mtt180 -94.49 -1.21 53.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.743 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 53' ' ' PRO . 11.9 mt -64.73 -47.41 75.45 Favored Pre-proline 0 CA--C 1.53 0.203 0 CA-C-O 120.605 0.24 . . . . 0.0 111.644 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.52 -26.81 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.732 2.288 . . . . 0.0 113.605 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.991 HD11 HD11 ' A' ' 17' ' ' ILE . 20.8 mt -69.71 -34.84 74.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.725 0.298 . . . . 0.0 111.242 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.501 ' CD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -56.52 -48.38 77.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.01 0.433 . . . . 0.0 110.887 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.474 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.0 p-10 -75.28 -31.01 60.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.867 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.924 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.69 -56.96 14.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.996 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.974 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -67.49 -37.64 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.458 -178.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.608 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 11.6 ttm-85 -37.37 -59.88 0.96 Allowed Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 90.8 Cg_exo -38.24 -37.14 0.6 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.86 2.373 . . . . 0.0 113.094 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.667 HD13 HD12 ' B' ' 101' ' ' LEU . 12.3 mt -65.2 -54.11 34.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.369 0.604 . . . . 0.0 110.047 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.53 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -44.31 129.02 4.67 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.148 179.552 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.404 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 78.4 Cg_exo -50.62 165.27 0.43 Allowed 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.63 2.22 . . . . 0.0 112.424 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.786 ' O ' HG23 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -56.16 -49.21 74.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.296 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -46.62 81.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.137 0.494 . . . . 0.0 110.418 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.561 ' CG ' HG21 ' A' ' 39' ' ' VAL . 29.2 m170 -64.95 -30.2 71.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.85 -32.28 69.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 0.0 110.298 179.547 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 68' ' ' LEU . 29.4 t -67.9 -46.2 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.061 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -69.18 -38.49 78.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.227 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.515 ' CD2' HG22 ' A' ' 43' ' ' VAL . 11.3 t80 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.335 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.451 ' O ' HG23 ' B' ' 104' ' ' VAL . 65.6 mt . . . . . 0 N--CA 1.463 0.181 0 CA-C-O 120.553 0.216 . . . . 0.0 111.466 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.667 HD12 HD13 ' A' ' 65' ' ' LEU . 8.6 tp -51.63 -52.64 46.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.827 0.346 . . . . 0.0 110.984 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -31.5 65.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.674 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -69.86 -32.58 71.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.804 HG22 ' HB1' ' A' ' 6' ' ' ALA . 1.6 t -71.04 -43.27 76.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.668 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.523 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.7 OUTLIER -65.67 -45.59 82.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.258 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.52 -33.64 73.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.63 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--N 1.33 -0.269 0 CA-C-O 121.024 0.44 . . . . 0.0 110.899 179.837 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 . . . . . 0 N--CA 1.465 0.323 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -59.02 -33.38 70.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.754 0.311 . . . . 0.0 110.763 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -56.95 -38.61 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.012 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.976 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.33 -50.93 58.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.071 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.415 ' HD2' ' HB3' ' B' ' 107' ' ' ASP . 0.0 OUTLIER -63.75 -26.92 68.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.238 179.432 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -49.15 51.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.626 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.669 ' HE2' HG21 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.18 -43.19 74.72 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -45.2 82.7 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.907 178.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 14.6 t-160 -57.69 -41.82 82.42 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.117 0.484 . . . . 0.0 109.852 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -60.14 -35.98 76.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.001 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.66 HG13 ' CD2' ' A' ' 58' ' ' LEU . 48.0 t -61.21 -47.7 92.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.32 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -57.6 -39.03 75.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.149 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -69.0 -34.66 75.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.429 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 17' ' ' ILE . 69.5 mt -95.88 6.28 49.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.508 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.609 HG22 ' O ' ' A' ' 17' ' ' ILE . 39.2 mm -148.08 69.03 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-O 121.708 0.766 . . . . 0.0 110.081 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.56 -33.51 66.21 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.016 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.82 164.26 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.771 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -98.82 -32.7 11.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.942 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.93 63.16 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.953 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' HG23 ' A' ' 17' ' ' ILE . 27.0 mt-10 -50.87 -34.69 29.16 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 19.3 mttt -73.29 -34.77 65.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.947 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.73 -40.57 97.07 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.14 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.897 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -67.17 -43.65 81.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 179.381 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.468 HD22 HG11 ' A' ' 13' ' ' VAL . 28.2 tp -61.5 -38.11 86.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.647 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 20.5 m-85 -63.22 -46.3 87.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.664 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -38.07 88.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.626 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 25' ' ' TYR . 34.8 t -62.24 -47.09 94.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.878 HD21 HD11 ' A' ' 62' ' ' ILE . 17.0 mt -64.39 -44.79 90.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.496 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -65.4 -35.09 79.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.415 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.404 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -68.34 -44.71 74.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.442 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.976 ' CD2' HD13 ' B' ' 101' ' ' LEU . 8.9 t80 -61.08 -36.07 78.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.115 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -74.43 -41.0 61.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.581 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.597 ' HG3' HG23 ' A' ' 36' ' ' THR . 15.7 pt20 -77.43 -52.51 9.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.987 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.597 HG23 ' HG3' ' A' ' 35' ' ' GLN . 17.7 p -79.38 -21.93 45.04 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.8 mmt 60.66 22.39 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.672 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.456 ' HB3' HG23 ' A' ' 41' ' ' VAL . 8.2 m-20 -104.13 119.77 39.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.776 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.76 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.9 t -79.14 -18.29 13.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.237 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.16 -29.63 48.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.456 HG23 ' HB3' ' A' ' 38' ' ' ASP . 46.6 t -73.47 -44.41 54.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.662 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.759 HD12 HD12 ' A' ' 46' ' ' LEU . 1.2 pp -68.98 -38.31 79.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.767 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 39' ' ' VAL . 70.8 t -66.82 -37.32 79.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.917 0.389 . . . . 0.0 110.422 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.4 -57.96 14.47 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.68 -0.772 . . . . 0.0 111.894 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.69 -41.7 99.25 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.945 0.403 . . . . 0.0 110.634 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.839 ' HG ' HG11 ' A' ' 29' ' ' VAL . 11.2 mt -52.19 -40.17 61.15 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.622 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -59.92 -46.61 88.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.386 179.468 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 mt -55.53 -36.72 67.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.485 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.631 HG13 HG13 ' A' ' 50' ' ' ILE . 14.6 p -101.13 4.53 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.394 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.916 HG23 ' O ' ' A' ' 55' ' ' ARG . 73.9 mt -142.52 29.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.26 0.552 . . . . 0.0 110.997 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.486 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.3 p30 -87.51 16.72 5.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.917 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.409 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 5.0 mm-40 -129.54 142.54 45.63 Favored Pre-proline 0 C--N 1.333 -0.11 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.65 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.538 ' HA ' HD12 ' A' ' 56' ' ' LEU . 85.7 Cg_exo -45.69 -39.01 17.83 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.205 1.936 . . . . 0.0 111.835 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 t -69.25 -35.14 75.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.698 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.916 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -89.96 -10.5 44.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.74 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.1 mt -53.08 -46.11 97.86 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 95.6 Cg_exo -44.17 -26.57 1.56 Allowed 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.727 2.285 . . . . 0.0 113.67 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.66 ' CD2' HG13 ' A' ' 13' ' ' VAL . 26.5 mt -73.67 -30.25 62.79 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.064 -0.254 . . . . 0.0 111.114 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.532 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -69.72 -44.35 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.987 0.422 . . . . 0.0 110.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.31 -31.42 60.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.848 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.523 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.66 -57.32 10.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.656 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.878 HD11 HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -65.83 -31.46 53.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.514 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.466 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 2.7 ttp180 -40.04 -59.58 1.75 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.5 Cg_endo -48.81 -26.1 9.27 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.801 2.334 . . . . 0.0 113.348 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.616 HD11 ' CE2' ' A' ' 9' ' ' PHE . 21.0 mt -65.01 -54.54 28.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.35 0.595 . . . . 0.0 109.694 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.582 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.1 mp -42.07 136.03 2.26 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.425 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.46 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 54.2 Cg_exo -52.24 165.79 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.807 2.338 . . . . 0.0 112.46 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.3 -55.96 25.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.16 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -50.24 74.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.419 . . . . 0.0 110.435 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.582 ' CB ' HG23 ' A' ' 66' ' ' ILE . 26.8 m170 -61.73 -28.24 69.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.178 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.77 -43.72 98.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.92 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.3 t -62.31 -45.22 99.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.96 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.04 -30.75 71.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.744 ' HE2' HD11 ' A' ' 42' ' ' LEU . 4.5 t80 . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.672 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.433 ' HB3' HD22 ' A' ' 65' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.893 0.378 . . . . 0.0 110.927 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.976 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.3 OUTLIER -56.46 -36.75 69.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.928 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.558 ' HA ' HD21 ' B' ' 105' ' ' LEU . 3.8 tttt -68.54 -32.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.819 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.96 -37.31 75.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.082 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.976 HG22 ' HB1' ' A' ' 6' ' ' ALA . 33.2 t -69.58 -54.54 19.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.518 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.57 HD12 ' N ' ' B' ' 106' ' ' GLU . 2.4 pp -57.34 -39.8 76.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.677 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . 0.57 ' N ' HD12 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -73.01 -34.86 66.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.342 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . 0.415 ' HB3' ' HD2' ' A' ' 7' ' ' ARG . 1.6 m-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.622 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.784 0.326 . . . . 0.0 110.883 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -59.61 -39.22 83.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.4 t -61.13 -35.06 63.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.882 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.968 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.02 -51.18 41.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.236 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.466 ' HA ' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -67.64 -26.87 66.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.25 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -73.18 -46.06 52.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.953 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.92 -44.74 65.56 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -63.89 -35.99 82.48 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 179.259 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.465 ' N ' ' HG3' ' A' ' 10' ' ' ARG . 20.5 t-160 -62.32 -42.66 99.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -61.1 -35.91 78.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.82 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.89 HG22 HD23 ' A' ' 58' ' ' LEU . 64.0 t -62.84 -44.85 99.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.306 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.48 -42.21 82.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.958 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -69.15 -37.17 78.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.267 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.3 mt -89.9 6.06 43.61 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.417 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.662 HG22 ' O ' ' A' ' 17' ' ' ILE . 37.4 mm -145.91 67.98 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 CA-C-O 121.743 0.782 . . . . 0.0 110.208 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.41 -31.26 67.55 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.917 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -73.32 122.27 21.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -62.88 -27.55 69.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.106 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.34 -52.02 63.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.899 0.38 . . . . 0.0 111.079 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.544 ' HB2' HG23 ' A' ' 17' ' ' ILE . 28.5 mt-10 -50.8 -34.59 28.14 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -71.72 -34.7 69.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.815 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.63 97.55 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.13 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.876 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -65.4 -44.71 86.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.333 179.326 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.44 -41.75 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.539 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -59.62 -43.25 93.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.523 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.65 -35.99 82.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.459 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.946 HG12 HD23 ' A' ' 42' ' ' LEU . 24.4 t -65.6 -44.98 93.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.849 HD21 HD11 ' A' ' 62' ' ' ILE . 19.2 mt -63.85 -44.4 93.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.489 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.6 mtp180 -59.73 -34.06 72.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.475 ' HG2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -65.21 -52.12 56.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.495 179.5 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' A' ' 37' ' ' MET . 6.3 t80 -55.98 -34.36 65.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.123 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -74.84 -43.95 51.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.805 0.336 . . . . 0.0 111.109 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.74 -54.91 5.8 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 p -84.42 -33.08 23.79 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.546 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.2 mmt 63.77 39.28 8.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.987 0.422 . . . . 0.0 110.665 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -113.71 125.21 53.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.73 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.858 ' O ' HG23 ' A' ' 43' ' ' VAL . 17.2 t -75.76 -14.0 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.988 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.71 -38.94 37.8 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.996 0.427 . . . . 0.0 110.215 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.475 HG11 ' HG2' ' A' ' 32' ' ' MET . 37.8 t -69.41 -34.04 60.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.88 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.961 HD22 HD11 ' A' ' 46' ' ' LEU . 1.7 mt -66.55 -50.71 62.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.549 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.858 HG23 ' O ' ' A' ' 39' ' ' VAL . 32.1 t -61.61 -38.13 79.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.29 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.61 -56.65 23.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.821 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.586 ' HB3' HG22 ' A' ' 29' ' ' VAL . 69.7 m-20 -72.95 -41.32 64.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.74 0.305 . . . . 0.0 111.341 -179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.961 HD11 HD22 ' A' ' 42' ' ' LEU . 30.5 mt -50.33 -45.19 54.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.949 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -61.78 -46.72 88.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.699 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.481 HD13 ' OH ' ' A' ' 25' ' ' TYR . 1.6 mt -50.83 -37.69 44.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.064 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.524 HG13 HG13 ' A' ' 50' ' ' ILE . 11.2 p -101.04 -6.55 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.491 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.884 HG23 ' O ' ' A' ' 55' ' ' ARG . 7.4 mt -129.3 31.0 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.105 0.479 . . . . 0.0 111.303 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.474 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.3 p30 -86.68 16.2 4.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.743 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -127.33 141.21 40.14 Favored Pre-proline 0 C--N 1.334 -0.1 0 C-N-CA 120.986 -0.285 . . . . 0.0 110.659 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.435 ' HA ' HD12 ' A' ' 56' ' ' LEU . 88.8 Cg_exo -46.15 -38.49 19.58 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.267 1.978 . . . . 0.0 111.678 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.5 p -69.36 -34.77 75.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.492 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.884 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -88.4 -13.91 39.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.589 -179.72 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.653 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 17.1 mt -50.34 -50.71 69.37 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 4.3 Cg_exo -40.06 -28.83 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.291 2.661 . . . . 0.0 113.754 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.89 HD23 HG22 ' A' ' 13' ' ' VAL . 7.5 mt -65.69 -32.04 73.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.767 0.318 . . . . 0.0 111.002 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.591 ' HD1' HG21 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -60.88 -40.65 93.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.319 179.52 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.408 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -75.13 -31.36 61.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.481 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.953 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -65.12 -57.91 7.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.198 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.881 HG13 HD12 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -65.35 -35.58 75.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.749 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.466 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 7.8 ttp180 -38.55 -58.25 1.65 Allowed Pre-proline 0 N--CA 1.468 0.44 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 9.5 Cg_endo -51.92 -28.42 31.52 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.597 2.198 . . . . 0.0 112.869 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.881 HD12 HG13 ' A' ' 62' ' ' ILE . 20.4 mt -65.2 -44.5 88.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.673 0.749 . . . . 0.0 109.371 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.581 HD11 HD13 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -62.54 130.08 93.18 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.643 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -51.86 165.46 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.566 2.177 . . . . 0.0 112.218 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -55.55 30.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.075 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmtt -57.36 -54.2 49.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.034 0.445 . . . . 0.0 110.417 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 14.8 m170 -59.6 -28.32 67.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.454 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -61.72 -44.07 97.62 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 30.7 t -65.2 -45.06 94.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.275 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.11 -27.04 67.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.444 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.596 ' CD1' HG22 ' A' ' 43' ' ' VAL . 56.7 t80 . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.517 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' A' ' 65' ' ' LEU . 7.9 mt . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.845 0.355 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.486 ' HA ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -53.5 -52.57 59.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 179.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.428 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -55.42 -32.74 62.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -39.27 85.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.968 HG22 ' HB1' ' A' ' 6' ' ' ALA . 21.7 t -71.03 -31.46 45.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.285 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.658 HD21 HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -68.53 -45.67 71.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.905 0.383 . . . . 0.0 110.3 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -69.4 -34.01 73.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.564 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.638 179.753 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.807 0.337 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -39.08 81.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.056 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.92 -40.66 63.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.213 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.57 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -66.07 -50.85 62.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 9.3 mtp180 -65.09 -26.72 68.34 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.01 -49.11 48.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.754 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.884 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.71 -41.61 71.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.071 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.17 92.53 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.818 178.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 12.3 m170 -59.29 -41.16 88.3 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 179.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -61.49 -34.52 75.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.171 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.806 HG13 ' CD2' ' A' ' 58' ' ' LEU . 47.8 t -62.13 -48.58 87.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -57.51 -40.18 78.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.175 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -69.06 -32.91 72.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.388 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -98.54 8.29 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.466 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.738 HG23 ' HB2' ' A' ' 22' ' ' GLU . 35.2 mm -147.68 68.56 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-O 121.721 0.772 . . . . 0.0 110.287 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -81.33 -8.82 59.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.274 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -66.93 -13.28 61.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.539 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.8 -61.61 0.49 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.609 0.242 . . . . 0.0 110.921 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.66 -48.73 66.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.916 0.388 . . . . 0.0 110.834 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.738 ' HB2' HG23 ' A' ' 17' ' ' ILE . 40.9 mt-10 -50.99 -34.45 29.13 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.78 -35.97 75.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.074 179.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.43 -44.61 86.8 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.998 0.428 . . . . 0.0 110.397 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 29' ' ' VAL . 13.4 t80 -60.84 -44.17 97.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.587 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.535 HD11 HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -59.29 -40.84 87.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.734 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -61.93 -41.43 97.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.768 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.36 -36.19 82.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.581 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.834 HG11 ' HG ' ' A' ' 46' ' ' LEU . 41.1 t -69.76 -36.63 70.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.835 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.78 HD21 HD11 ' A' ' 62' ' ' ILE . 11.4 mt -70.24 -43.59 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.652 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.5 ttt85 -66.81 -35.45 80.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.485 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 23.7 tpp -69.14 -43.76 73.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.397 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.659 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.3 t80 -62.13 -39.64 93.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.905 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.489 ' HD2' HD11 ' B' ' 101' ' ' LEU . 58.8 t-80 -74.86 -41.38 59.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.399 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -54.99 5.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.855 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 p -76.53 -23.14 53.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.84 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.437 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.5 mmt 63.64 18.38 11.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.771 0.319 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.618 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.0 OUTLIER -97.87 116.6 30.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.757 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.794 ' O ' HG23 ' A' ' 43' ' ' VAL . 19.5 t -79.41 -21.41 12.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.203 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.33 -30.81 54.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.877 0.37 . . . . 0.0 110.697 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.618 HG23 ' HB3' ' A' ' 38' ' ' ASP . 40.8 t -73.55 -41.88 55.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.677 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.685 HD12 HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -69.75 -38.09 76.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.696 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 39' ' ' VAL . 76.4 t -65.87 -37.21 79.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 CA-C-O 120.961 0.41 . . . . 0.0 110.212 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.04 -57.98 13.65 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.962 179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -60.92 -44.37 97.28 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.021 0.438 . . . . 0.0 110.472 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.834 ' HG ' HG11 ' A' ' 29' ' ' VAL . 10.7 mt -51.02 -40.73 58.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.3 OUTLIER -59.34 -50.24 74.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.271 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mp -51.45 -37.25 47.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.811 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.609 HG13 HG13 ' A' ' 50' ' ' ILE . 14.9 p -101.0 3.7 10.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.435 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.855 HG23 ' O ' ' A' ' 55' ' ' ARG . 71.3 mt -140.4 29.64 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' A' ' 47' ' ' LYS . 27.0 m-20 -84.32 11.19 8.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.871 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.417 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 20.1 mm-40 -127.3 148.76 67.53 Favored Pre-proline 0 C--O 1.231 0.103 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.807 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.451 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.69 -37.8 65.0 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.45 2.1 . . . . 0.0 111.445 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.29 -32.49 71.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.296 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.855 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.9 mtp180 -91.31 -9.22 45.81 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.391 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.5 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 18.1 mt -57.01 -44.55 99.83 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.718 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.17 -27.34 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.689 2.26 . . . . 0.0 113.577 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.806 ' CD2' HG13 ' A' ' 13' ' ' VAL . 15.8 mt -70.51 -30.27 66.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.692 0.282 . . . . 0.0 111.037 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.486 ' HE1' ' HH ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.378 . . . . 0.0 110.637 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.419 ' O ' ' HD2' ' A' ' 64' ' ' PRO . 3.0 m-20 -75.48 -31.27 60.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.805 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.884 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -65.57 -64.49 0.85 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.453 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.78 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.7 -28.32 44.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.447 ' HG2' ' CE2' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -41.72 -63.96 0.75 Allowed Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -178.857 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.43 ' HG2' ' O ' ' A' ' 61' ' ' ALA . 2.4 Cg_endo -46.25 -26.98 4.26 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.963 2.442 . . . . 0.0 113.214 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.572 HD12 ' CG1' ' A' ' 62' ' ' ILE . 16.1 mt -65.41 -51.86 57.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 109.542 179.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.445 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.0 OUTLIER -47.68 129.89 11.05 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.7 -1.137 . . . . 0.0 111.156 179.458 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.443 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 53.7 Cg_exo -52.86 165.8 1.08 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.693 2.262 . . . . 0.0 112.418 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.9 mt -54.94 -56.85 15.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.135 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -54.6 44.58 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.249 0.547 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.445 ' CB ' HG23 ' A' ' 66' ' ' ILE . 20.1 m170 -57.54 -29.35 64.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.219 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.74 -44.26 96.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.846 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -59.29 -46.68 92.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.824 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.47 -31.13 71.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.99 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.651 ' HE1' HD11 ' A' ' 42' ' ' LEU . 2.3 t80 . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.354 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' B' ' 100' ' ' LEU . 17.5 mt . . . . . 0 N--CA 1.463 0.2 0 CA-C-O 120.663 0.268 . . . . 0.0 111.718 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.609 HD22 ' CE2' ' A' ' 33' ' ' TYR . 1.8 pp -51.59 -40.58 60.09 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.764 0.316 . . . . 0.0 110.871 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -33.84 74.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.329 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.04 -32.43 70.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.569 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.705 HG11 ' CZ ' ' A' ' 9' ' ' PHE . 2.0 t -68.78 -39.92 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.48 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.57 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.5 OUTLIER -65.12 -45.64 84.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.334 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -33.83 73.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.616 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.735 179.818 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.816 0.341 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.52 71.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.3 t -57.78 -38.34 64.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.26 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.788 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -68.1 -50.94 51.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.15 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -26.7 67.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.174 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.19 -48.27 52.55 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.461 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.738 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -70.77 -43.2 69.27 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -58.05 -42.18 84.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.696 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.04 -44.65 94.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.436 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HD2' ' HA ' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -61.58 -32.56 72.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.215 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 9' ' ' PHE . 49.0 t -62.32 -49.37 84.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.123 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -57.65 -37.94 74.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.851 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.92 -41.81 77.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.336 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.5 ' O ' HD13 ' A' ' 17' ' ' ILE . 3.4 mt -87.42 4.89 41.42 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.357 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.654 HG22 ' O ' ' A' ' 17' ' ' ILE . 41.6 mm -143.0 67.07 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-O 121.785 0.802 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -54.41 -31.25 54.7 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.975 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -73.13 164.64 26.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.619 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.32 -28.68 13.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.991 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.54 -51.64 67.74 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.533 ' HB2' HG23 ' A' ' 17' ' ' ILE . 27.4 mt-10 -50.9 -34.77 29.79 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 17.9 mttt -71.53 -34.9 70.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.966 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.97 -42.87 99.18 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -67.87 -40.5 83.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 179.451 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.504 HD22 HG11 ' A' ' 13' ' ' VAL . 0.1 OUTLIER -61.22 -46.03 92.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.63 179.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 15.4 m-30 -60.51 -42.65 96.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.729 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.73 -37.68 88.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.709 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 25' ' ' TYR . 46.6 t -63.62 -51.82 65.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.894 HD21 HD11 ' A' ' 62' ' ' ILE . 6.2 mt -60.56 -37.87 82.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.606 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.2 mmt-85 -65.23 -41.24 94.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.383 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.9 mmt -64.09 -46.83 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.462 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.692 ' CE1' HG22 ' A' ' 39' ' ' VAL . 13.0 t80 -59.59 -37.79 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.043 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -74.71 -44.76 48.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.563 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -55.15 5.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.151 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -75.21 -20.78 59.09 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.413 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 1.3 mmt 61.11 20.15 10.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.68 0.276 . . . . 0.0 110.7 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.485 ' HB3' HG23 ' A' ' 41' ' ' VAL . 3.9 t0 -104.73 120.68 41.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.91 0.386 . . . . 0.0 110.864 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.831 ' O ' HG23 ' A' ' 43' ' ' VAL . 44.5 t -79.67 -16.61 13.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.21 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.51 -28.45 56.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.879 0.371 . . . . 0.0 110.947 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.485 HG23 ' HB3' ' A' ' 38' ' ' ASP . 53.2 t -73.18 -45.25 54.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.751 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.736 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.4 pp -67.92 -38.6 83.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.751 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 39' ' ' VAL . 71.2 t -61.03 -38.99 80.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.003 0.43 . . . . 0.0 110.372 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.71 -59.19 8.47 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.157 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.466 ' CB ' HG22 ' A' ' 29' ' ' VAL . 76.6 m-20 -60.53 -45.03 95.33 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.781 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.811 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.9 mt -50.81 -44.48 59.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.2 tppt? -57.91 -46.61 84.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.567 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.09 -37.64 64.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.736 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.5 p -100.97 2.87 10.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.468 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.874 HG23 ' O ' ' A' ' 55' ' ' ARG . 53.2 mt -139.13 29.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.406 0.622 . . . . 0.0 110.955 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.478 ' N ' ' O ' ' A' ' 47' ' ' LYS . 28.6 p30 -86.28 17.65 3.59 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.873 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.431 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 24.2 mm-40 -126.03 141.22 38.94 Favored Pre-proline 0 N--CA 1.458 -0.05 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.439 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.464 ' HA ' HD12 ' A' ' 56' ' ' LEU . 85.4 Cg_exo -45.42 -38.9 16.24 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.157 1.905 . . . . 0.0 111.884 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.2 t -69.4 -36.03 76.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.851 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.874 ' O ' HG23 ' A' ' 50' ' ' ILE . 61.0 mtt85 -87.82 -15.73 36.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.768 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.653 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 15.8 mt -46.54 -51.92 33.35 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.0 Cg_exo -39.13 -29.17 0.18 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.358 2.706 . . . . 0.0 113.739 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.591 HD21 HG13 ' A' ' 13' ' ' VAL . 1.0 OUTLIER -60.61 -30.14 69.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.821 0.344 . . . . 0.0 111.041 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.634 ' HD1' HG21 ' A' ' 50' ' ' ILE . 2.0 m-85 -69.61 -40.32 76.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 7.1 m-20 -75.28 -31.07 60.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.937 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.604 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.93 -61.85 1.63 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.047 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.894 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -58.34 -36.17 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.968 -179.27 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 17.9 ttp180 -41.35 -66.68 0.37 Allowed Pre-proline 0 CA--C 1.538 0.487 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.11 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 88.9 Cg_exo -34.55 -33.62 0.08 OUTLIER 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.309 2.673 . . . . 0.0 113.497 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.481 HD11 ' CE2' ' A' ' 9' ' ' PHE . 6.8 mt -64.77 -53.59 44.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 110.141 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.622 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.6 OUTLIER -38.74 128.89 1.15 Allowed Pre-proline 0 CA--C 1.537 0.463 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.647 179.595 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.405 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 50.8 Cg_exo -54.08 165.7 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.687 2.258 . . . . 0.0 112.251 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.9 mt -52.21 -51.28 59.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.264 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.628 ' O ' HG12 ' A' ' 72' ' ' VAL . 7.7 mmtm -57.89 -60.11 4.22 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.218 0.532 . . . . 0.0 110.387 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.622 ' HB2' HG23 ' A' ' 66' ' ' ILE . 18.5 m170 -60.12 -19.87 55.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.618 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.21 -53.55 29.19 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.628 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.4 p -61.65 -35.26 66.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.248 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -70.92 -42.99 69.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.088 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.232 179.346 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.0 mt . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.881 0.372 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.618 HD13 HD21 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -51.76 -53.03 44.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -60.48 -31.81 70.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.777 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.56 -40.04 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.76 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.788 HG22 ' HB1' ' A' ' 6' ' ' ALA . 9.4 t -71.06 -40.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.856 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.618 HD21 HD13 ' B' ' 101' ' ' LEU . 1.1 mt -63.33 -45.7 90.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.035 0.445 . . . . 0.0 109.981 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -60.39 -38.69 84.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.466 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.572 179.701 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.895 0.379 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -65.0 -35.41 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.2 t -61.75 -35.05 65.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.202 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.055 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -68.69 -50.97 46.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.209 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 2.8 ttp180 -63.9 -26.84 68.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.422 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.73 -49.32 48.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.66 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.93 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.6 -43.36 72.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -44.76 81.57 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.933 178.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.4 t-160 -58.24 -42.75 87.03 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 109.817 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -59.62 -32.96 70.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.199 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.594 HG13 ' CD2' ' A' ' 58' ' ' LEU . 44.9 t -64.57 -47.58 88.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.58 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -57.6 -41.07 80.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.382 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.97 -31.42 70.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.742 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -101.4 8.96 41.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.611 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 17' ' ' ILE . 37.4 mm -149.06 69.04 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-O 121.701 0.763 . . . . 0.0 110.148 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.81 -36.13 76.11 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.789 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -63.79 150.17 45.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.672 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -86.89 -30.18 21.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.091 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.61 -52.63 63.57 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.004 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.544 ' CD ' HD12 ' A' ' 17' ' ' ILE . 17.2 mt-10 -50.88 -34.7 29.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 82.2 mttt -72.74 -34.27 66.92 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.89 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.1 -45.5 88.38 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.153 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.924 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.8 OUTLIER -62.49 -42.81 99.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.158 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.69 HD12 HG11 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -58.18 -40.99 82.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.441 179.405 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 13.4 m-30 -61.01 -43.03 99.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.293 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -68.61 -36.69 79.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.608 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 25' ' ' TYR . 32.6 t -64.56 -50.43 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.705 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.016 HD21 HD11 ' A' ' 62' ' ' ILE . 18.0 mt -60.62 -40.66 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.514 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.71 -39.07 87.18 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.329 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.6 mmt -60.71 -52.08 66.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.349 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.595 ' CG ' HD11 ' A' ' 42' ' ' LEU . 8.7 t80 -53.53 -40.82 65.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.323 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -74.39 -38.2 63.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.86 0.362 . . . . 0.0 111.354 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -54.87 5.89 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -86.22 -25.56 25.54 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.52 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.4 mmt 61.56 35.11 17.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 110.655 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.51 ' HB3' HG23 ' A' ' 41' ' ' VAL . 9.7 t0 -114.97 124.56 51.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.855 ' O ' HG23 ' A' ' 43' ' ' VAL . 15.8 t -76.74 -12.64 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.192 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.15 -36.05 55.58 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 120.948 0.404 . . . . 0.0 110.287 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.51 HG23 ' HB3' ' A' ' 38' ' ' ASP . 34.8 t -70.13 -34.93 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.129 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.78 ' CD2' HG12 ' A' ' 29' ' ' VAL . 7.3 mt -66.61 -49.18 67.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.585 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 39' ' ' VAL . 26.2 t -58.15 -37.48 62.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.073 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.26 -59.58 8.74 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.826 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.593 ' HA ' HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -68.07 -42.93 79.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.889 0.376 . . . . 0.0 111.21 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' A' ' 50' ' ' ILE . 41.7 mt -50.45 -47.53 56.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -58.27 -45.23 88.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 45' ' ' ASP . 3.1 mt -53.21 -40.88 64.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.69 HG11 HD12 ' A' ' 26' ' ' LEU . 14.8 p -101.08 4.22 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.449 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.874 HG23 ' O ' ' A' ' 55' ' ' ARG . 60.0 mt -140.2 29.55 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.217 0.532 . . . . 0.0 111.219 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.481 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.4 p30 -89.2 15.73 8.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.628 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -129.59 150.12 74.8 Favored Pre-proline 0 C--N 1.333 -0.132 0 C-N-CA 121.126 -0.229 . . . . 0.0 110.491 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.478 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.68 -38.69 66.61 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.325 2.017 . . . . 0.0 111.429 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 t -69.42 -36.8 77.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.608 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.874 ' O ' HG23 ' A' ' 50' ' ' ILE . 53.5 mtt85 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.647 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.682 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.1 mt -53.45 -49.78 86.55 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.682 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.7 Cg_endo -41.16 -27.91 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.022 2.482 . . . . 0.0 113.493 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.594 ' CD2' HG13 ' A' ' 13' ' ' VAL . 6.7 mt -70.74 -35.27 72.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.782 0.325 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.428 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -58.04 -44.73 87.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.265 179.325 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.2 OUTLIER -75.31 -31.08 60.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.675 179.512 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.93 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.31 -59.85 4.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 1.016 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.52 -38.04 76.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.34 -179.241 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.453 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -38.13 -66.29 0.31 Allowed Pre-proline 0 N--CA 1.469 0.476 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 82.3 Cg_exo -38.69 -32.12 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.835 2.357 . . . . 0.0 113.512 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.87 HD12 HG13 ' A' ' 62' ' ' ILE . 19.4 mt -65.44 -46.47 79.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.656 0.741 . . . . 0.0 109.851 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.472 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -54.52 133.47 63.4 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.18 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.74 165.56 0.73 Allowed 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.496 2.131 . . . . 0.0 112.168 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.2 tp -56.59 -57.09 13.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.979 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -57.86 -52.17 66.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.117 0.485 . . . . 0.0 110.388 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 22.7 m170 -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.452 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.26 -43.5 98.7 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.188 179.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.8 -45.87 97.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.118 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.14 93.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.072 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.403 ' OH ' ' CD2' ' A' ' 59' ' ' PHE . 53.5 t80 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.324 179.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 28.4 mt . . . . . 0 C--O 1.233 0.191 0 CA-C-O 120.831 0.348 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.65 ' HA ' HD13 ' A' ' 65' ' ' LEU . 0.4 OUTLIER -52.02 -39.47 59.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.843 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.43 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 28.2 ttpp -61.01 -42.46 98.5 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.598 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.23 -38.48 83.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.897 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.055 HG22 ' HB1' ' A' ' 6' ' ' ALA . 23.8 t -68.03 -37.08 77.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.362 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.526 HD22 ' HB3' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -61.92 -44.06 97.56 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 178.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.51 -36.82 84.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.606 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 179.801 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.1 ttt-85 . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 120.801 0.334 . . . . 0.0 110.959 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -35.43 81.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.39 -40.13 85.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.99 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.701 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.78 -50.95 54.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 5.7 ttp180 -66.15 -26.9 67.64 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.12 179.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -71.69 -48.93 44.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.408 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.644 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.5 -43.02 73.98 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -43.3 90.17 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.664 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.409 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 17.3 t-160 -57.27 -42.26 81.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.866 178.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -59.32 -36.81 76.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.157 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.88 HG22 HD22 ' A' ' 58' ' ' LEU . 46.2 t -60.24 -46.68 94.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.315 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -57.6 -41.48 81.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.153 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.0 -31.77 70.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.603 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.5 mt -97.18 6.03 49.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.406 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.663 HG22 ' O ' ' A' ' 17' ' ' ILE . 37.5 mm -145.32 67.78 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 121.721 0.772 . . . . 0.0 110.029 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.64 -33.81 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.927 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.48 165.8 13.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.654 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -101.65 -32.97 10.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.985 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.19 74.37 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.419 ' HB2' HG23 ' A' ' 17' ' ' ILE . 5.1 mt-10 -50.77 -34.57 27.8 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 36.5 mttt -72.91 -34.82 66.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.897 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -63.78 -42.69 97.71 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.227 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.838 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 t80 -64.83 -45.16 87.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' HG21 ' A' ' 49' ' ' VAL . 7.9 mt -60.66 -38.98 86.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.501 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.7 m-85 -61.34 -44.63 96.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.588 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.68 -33.96 77.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.597 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.838 HG23 ' O ' ' A' ' 25' ' ' TYR . 42.3 t -65.52 -47.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.796 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.021 HD21 HD11 ' A' ' 62' ' ' ILE . 6.2 mt -61.84 -42.71 99.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.661 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.18 -40.87 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.493 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -47.02 86.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.144 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.78 ' CD2' HD22 ' B' ' 101' ' ' LEU . 4.9 t80 -55.58 -46.45 77.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.875 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -74.9 -33.63 62.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.578 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -77.3 -55.05 5.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.9 p -89.51 -10.82 44.83 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.444 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.8 mmt 59.63 24.51 13.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.731 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.76 ' HB3' HG23 ' A' ' 41' ' ' VAL . 5.1 m-20 -101.09 117.44 35.03 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.975 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.817 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.3 t -79.86 -21.93 11.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.009 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.61 -28.43 56.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.766 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.76 HG23 ' HB3' ' A' ' 38' ' ' ASP . 43.7 t -73.46 -44.19 54.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.759 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 46' ' ' LEU . 2.4 pp -68.4 -38.39 81.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.74 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.817 HG23 ' O ' ' A' ' 39' ' ' VAL . 91.5 t -63.95 -42.28 95.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.336 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.81 -58.36 14.63 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.165 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.403 ' CB ' HG22 ' A' ' 29' ' ' VAL . 6.2 m-20 -60.54 -40.17 90.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.975 0.417 . . . . 0.0 110.709 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 42' ' ' LEU . 12.3 mt -51.9 -43.19 63.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.608 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HD3' ' CZ ' ' A' ' 59' ' ' PHE . 1.6 tppt? -57.9 -47.48 82.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.14 0.495 . . . . 0.0 110.514 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.25 -36.39 63.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.71 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.566 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.9 p -101.22 2.25 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.553 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.908 HG23 ' O ' ' A' ' 55' ' ' ARG . 53.4 mt -140.15 29.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-O 121.29 0.566 . . . . 0.0 110.869 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.473 ' N ' ' O ' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -87.24 17.59 4.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.966 -179.869 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.407 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 3.5 mt-10 -128.36 142.2 43.9 Favored Pre-proline 0 CA--C 1.523 -0.07 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.54 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.575 ' HA ' HD12 ' A' ' 56' ' ' LEU . 81.8 Cg_exo -46.75 -38.26 22.38 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.148 1.899 . . . . 0.0 111.498 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -35.66 76.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.583 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.908 ' O ' HG23 ' A' ' 50' ' ' ILE . 18.9 mtt85 -90.83 -7.22 52.91 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.808 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 53' ' ' PRO . 13.3 mt -57.15 -46.02 99.88 Favored Pre-proline 0 CA--C 1.531 0.244 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.49 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 91.2 Cg_exo -43.77 -26.76 1.33 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.766 2.31 . . . . 0.0 113.729 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.88 HD22 HG22 ' A' ' 13' ' ' VAL . 8.5 mt -73.44 -30.29 63.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.757 0.313 . . . . 0.0 111.015 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.478 ' CZ ' ' HD3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -60.99 -48.45 81.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.618 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.442 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.9 OUTLIER -75.19 -31.0 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.77 179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.483 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.73 -58.2 9.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.776 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 1.021 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.92 -36.85 77.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.957 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.436 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 1.1 ttp85 -36.5 -62.82 0.49 Allowed Pre-proline 0 N--CA 1.469 0.489 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.454 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.6 Cg_exo -33.97 -36.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.406 2.737 . . . . 0.0 113.545 -179.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.723 HD11 HG21 ' B' ' 104' ' ' VAL . 15.2 mt -65.09 -56.8 10.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.413 0.625 . . . . 0.0 109.951 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.457 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -44.24 133.65 4.4 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.187 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -50.94 165.34 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.607 2.205 . . . . 0.0 112.437 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.98 -55.38 33.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.05 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.626 ' O ' HG12 ' A' ' 72' ' ' VAL . 19.1 tttm -57.52 -53.97 52.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.178 0.513 . . . . 0.0 110.342 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.537 ' CG ' HG21 ' A' ' 39' ' ' VAL . 44.5 m170 -60.99 -22.22 64.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.482 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.11 -54.93 16.78 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.974 0.416 . . . . 0.0 110.454 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.4 p -59.18 -35.11 55.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.183 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -68.47 -37.37 80.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.968 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.547 ' CD2' HG22 ' A' ' 43' ' ' VAL . 9.5 t80 . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.216 179.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.403 ' HB3' ' CD2' ' A' ' 65' ' ' LEU . 10.9 mt . . . . . 0 C--O 1.233 0.213 0 CA-C-O 120.844 0.354 . . . . 0.0 110.972 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.78 HD22 ' CD2' ' A' ' 33' ' ' TYR . 53.2 tp -51.77 -52.76 46.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.459 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -57.15 -31.57 65.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.595 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.22 -40.26 95.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.723 HG21 HD11 ' A' ' 65' ' ' LEU . 2.0 t -70.94 -36.17 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.929 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.574 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -72.0 -45.51 60.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.847 0.356 . . . . 0.0 110.484 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -70.06 -33.82 72.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.774 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.756 179.816 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.7 mtt85 . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 120.888 0.375 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -33.58 71.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.514 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.04 -39.3 71.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.1 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.987 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.09 -50.91 60.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -64.91 -26.9 68.51 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.188 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -70.61 -49.12 51.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.526 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.81 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.75 -43.57 72.0 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.083 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.93 -41.82 88.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.736 178.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 -58.7 -42.3 88.27 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.784 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -59.91 -36.0 76.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.01 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 9' ' ' PHE . 45.0 t -60.5 -49.09 85.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.519 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -57.63 -38.74 75.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.308 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.95 -35.3 76.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.421 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 17' ' ' ILE . 74.2 mt -95.25 5.44 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.46 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.585 HG22 ' O ' ' A' ' 17' ' ' ILE . 40.5 mm -147.61 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 121.611 0.719 . . . . 0.0 110.224 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -56.42 -39.72 73.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.891 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.17 179.17 0.15 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.681 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -111.44 -32.26 6.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.2 -53.02 62.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.538 ' HB2' HG23 ' A' ' 17' ' ' ILE . 37.5 mt-10 -50.81 -35.04 30.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 7.2 mttt -73.25 -34.26 65.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.904 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.48 -41.27 98.57 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.638 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -65.08 -46.07 82.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.218 179.33 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.429 HD22 HG11 ' A' ' 13' ' ' VAL . 5.1 tp -60.55 -36.6 78.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.65 ' HA ' HD12 ' A' ' 30' ' ' LEU . 21.8 m-85 -62.83 -44.86 95.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.615 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.2 -40.55 90.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.548 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 25' ' ' TYR . 22.2 t -60.29 -47.88 90.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.921 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.846 HD21 HD11 ' A' ' 62' ' ' ILE . 4.8 mt -59.87 -44.71 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.45 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -32.99 69.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.348 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.445 ' O ' ' N ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -64.48 -55.36 21.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.283 179.563 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.485 ' HB3' HD21 ' B' ' 101' ' ' LEU . 0.1 OUTLIER -53.45 -34.45 57.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -74.85 -53.38 9.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.523 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.27 -55.18 5.64 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' MET . 17.8 p -86.67 -47.64 8.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.658 0.266 . . . . 0.0 111.583 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 75.45 32.41 0.72 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.863 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.709 ' O ' HD12 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -101.24 120.19 39.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.749 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.915 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.3 t -78.22 -16.54 13.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.252 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -36.55 53.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.99 0.424 . . . . 0.0 110.327 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 38' ' ' ASP . 26.3 t -72.81 -34.17 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.018 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.709 HD12 ' O ' ' A' ' 38' ' ' ASP . 0.2 OUTLIER -67.9 -44.31 77.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.89 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.915 HG23 ' O ' ' A' ' 39' ' ' VAL . 59.5 t -57.46 -40.0 72.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.816 0.341 . . . . 0.0 110.925 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.49 -57.68 10.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.757 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.46 ' HB3' HG22 ' A' ' 29' ' ' VAL . 2.1 m-20 -63.61 -48.91 75.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.999 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HG ' HG11 ' A' ' 29' ' ' VAL . 51.2 mt -50.48 -44.45 55.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.016 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.39 -46.64 89.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.094 0.473 . . . . 0.0 110.463 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mt -51.98 -37.63 53.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.699 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.584 HG13 HG13 ' A' ' 50' ' ' ILE . 14.8 p -101.11 1.74 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.454 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.868 HG23 ' O ' ' A' ' 55' ' ' ARG . 58.3 mt -135.13 27.41 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.304 0.573 . . . . 0.0 111.136 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 23.2 m-20 -84.39 12.08 7.4 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.885 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -126.29 145.41 52.53 Favored Pre-proline 0 C--O 1.231 0.11 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.767 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.425 ' HA ' HD12 ' A' ' 56' ' ' LEU . 71.9 Cg_exo -47.95 -38.81 31.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.318 2.012 . . . . 0.0 111.692 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 p -69.27 -35.94 76.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.545 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.868 ' O ' HG23 ' A' ' 50' ' ' ILE . 63.3 mtt85 -88.02 -8.55 55.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.636 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.636 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 16.6 mt -55.43 -53.48 61.71 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.531 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.636 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.2 Cg_exo -39.04 -29.19 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.362 2.708 . . . . 0.0 113.641 -179.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.714 HD12 HG12 ' A' ' 50' ' ' ILE . 35.7 mt -60.94 -37.03 80.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -44.1 97.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.585 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.447 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.9 m-20 -75.0 -31.18 61.34 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.647 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.81 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.82 -62.31 1.73 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.752 -179.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.846 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.84 -35.06 71.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.055 -179.173 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.479 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 5.8 ttt-85 -38.05 -65.32 0.38 Allowed Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 76.7 Cg_exo -36.16 -33.7 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 123.084 2.523 . . . . 0.0 113.406 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.607 HD11 ' CE2' ' A' ' 9' ' ' PHE . 16.5 mt -65.14 -51.68 59.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.349 0.595 . . . . 0.0 110.128 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.522 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -45.08 132.15 5.47 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.351 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.472 ' HG2' ' HB2' ' A' ' 70' ' ' HIS . 2.8 Cg_endo -48.25 165.68 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.61 2.206 . . . . 0.0 112.123 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.1 tp -55.39 -56.12 23.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.419 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.1 pttt -56.3 -52.62 63.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.522 ' CB ' HG23 ' A' ' 66' ' ' ILE . 25.0 m170 -62.88 -29.19 70.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.477 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.03 -43.88 87.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.016 0.436 . . . . 0.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 t -67.85 -47.76 78.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.269 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.81 -27.9 69.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.508 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.591 ' OH ' HD13 ' A' ' 46' ' ' LEU . 23.0 t80 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.694 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 6.3 mt . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.811 0.338 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.513 ' HA ' HD13 ' A' ' 65' ' ' LEU . 40.5 tp -51.92 -52.62 48.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.99 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.424 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.0 OUTLIER -54.99 -35.35 64.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.923 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.04 -38.57 91.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.987 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.1 t -69.8 -34.24 59.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.102 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.492 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.1 mt -64.44 -45.61 86.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.957 0.408 . . . . 0.0 109.959 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -35.19 80.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.566 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.575 179.746 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.689 0.281 . . . . 0.0 111.643 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -34.75 72.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.811 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.42 -37.58 80.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.025 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.04 -49.84 53.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.717 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -26.71 68.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.335 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -70.06 -49.31 52.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.449 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.608 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -69.86 -42.54 73.38 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.1 ttp85 -57.47 -44.1 84.6 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.664 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 18.3 t-160 -57.8 -43.33 85.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.209 0.528 . . . . 0.0 109.789 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -59.18 -35.23 73.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.193 179.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.806 HG22 ' CD2' ' A' ' 58' ' ' LEU . 61.5 t -62.05 -46.65 96.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.271 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -57.59 -39.3 76.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.005 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -69.07 -36.1 77.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.541 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.401 HD13 ' HG2' ' A' ' 57' ' ' PRO . 14.6 mt -96.49 8.39 44.21 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.572 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.666 HG22 ' O ' ' A' ' 17' ' ' ILE . 34.5 mm -150.06 69.53 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-O 121.625 0.726 . . . . 0.0 109.986 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.85 -33.52 70.53 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.03 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -60.89 175.47 0.49 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -110.26 -30.44 7.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.71 -51.23 63.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.973 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' A' ' 17' ' ' ILE . 35.1 mt-10 -50.78 -34.69 28.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 73.4 mttt -72.14 -35.5 69.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.003 178.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.45 -40.66 97.35 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.049 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.304 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.589 HD12 HG21 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.71 -38.62 78.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.56 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 14.1 m-30 -64.73 -45.43 86.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.7 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.74 -38.04 89.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.886 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 25' ' ' TYR . 36.3 t -63.0 -50.71 78.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.016 0.436 . . . . 0.0 110.952 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.96 HD21 HD11 ' A' ' 62' ' ' ILE . 13.0 mt -62.71 -40.41 97.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.483 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -65.36 -40.55 93.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.4 tpt -62.21 -44.85 95.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.371 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.711 ' CD2' HD13 ' B' ' 101' ' ' LEU . 6.3 t80 -57.45 -45.09 85.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.017 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -74.59 -33.67 62.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -55.0 5.8 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -82.33 -19.8 38.63 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 3.7 mmt 63.36 26.82 15.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.883 0.373 . . . . 0.0 110.652 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -114.06 121.39 43.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.81 ' O ' HG23 ' A' ' 43' ' ' VAL . 22.0 t -78.38 -16.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.238 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.78 54.79 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.915 0.388 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.53 -43.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.793 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.672 HD12 HD12 ' A' ' 46' ' ' LEU . 3.4 pp -69.01 -38.28 79.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.629 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 39' ' ' VAL . 79.5 t -61.56 -44.34 98.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.942 0.401 . . . . 0.0 110.377 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.31 -58.89 11.69 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.243 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.569 ' HA ' HD12 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -60.55 -39.32 87.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.819 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.771 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.0 mt -52.35 -45.02 65.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -57.36 -48.63 78.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.337 179.469 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.569 HD12 ' HA ' ' A' ' 45' ' ' ASP . 0.9 OUTLIER -51.07 -39.46 56.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.873 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 49' ' ' VAL . 10.9 p -100.94 4.93 10.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.42 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.871 HG23 ' O ' ' A' ' 55' ' ' ARG . 62.3 mt -138.34 27.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.257 0.551 . . . . 0.0 110.868 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 47' ' ' LYS . 22.5 m-20 -84.69 12.59 6.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.835 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -125.37 148.31 60.71 Favored Pre-proline 0 C--N 1.334 -0.083 0 C-N-CA 121.13 -0.228 . . . . 0.0 110.552 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.491 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.79 -38.14 66.77 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.37 2.047 . . . . 0.0 111.466 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.6 p -69.54 -32.7 71.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.47 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.871 ' O ' HG23 ' A' ' 50' ' ' ILE . 86.2 mtt180 -90.57 -11.46 39.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.572 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.5 mt -55.97 -45.91 99.83 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.675 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.486 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.9 Cg_exo -44.32 -24.88 1.1 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.786 2.324 . . . . 0.0 113.532 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.806 ' CD2' HG22 ' A' ' 13' ' ' VAL . 6.9 mt -73.12 -35.35 66.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.747 0.308 . . . . 0.0 110.984 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -59.06 -46.04 89.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 0.0 110.751 179.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.433 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.3 m-20 -75.04 -30.95 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.85 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.582 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -64.96 -63.39 1.12 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.984 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.96 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -59.03 -37.42 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.457 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.7 mtm180 -38.45 -66.39 0.31 Allowed Pre-proline 0 N--CA 1.468 0.444 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 79.3 Cg_exo -37.05 -30.69 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.214 2.609 . . . . 0.0 113.54 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.608 HD11 ' CE2' ' A' ' 9' ' ' PHE . 16.2 mt -65.18 -49.82 68.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.524 0.678 . . . . 0.0 109.651 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.537 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -53.07 138.42 46.12 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.744 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -48.34 165.46 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.691 2.26 . . . . 0.0 112.427 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.435 ' O ' HG23 ' A' ' 72' ' ' VAL . 3.6 tp -56.93 -57.11 13.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.967 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -57.13 -53.59 56.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.129 0.49 . . . . 0.0 110.251 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.537 ' CB ' HG23 ' A' ' 66' ' ' ILE . 24.1 m170 -59.21 -28.73 66.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.451 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.31 -42.23 93.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 68' ' ' LEU . 23.3 t -62.89 -42.78 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.497 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -64.46 -45.68 86.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.341 179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.645 ' CD2' HG22 ' A' ' 43' ' ' VAL . 8.5 t80 . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.375 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.796 0.331 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.711 HD13 ' CD2' ' A' ' 33' ' ' TYR . 2.6 pt? -51.81 -43.84 63.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.848 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.458 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 8.6 tttp -59.34 -33.91 71.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.382 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -68.1 -36.45 79.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.56 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.025 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.9 t -68.37 -34.15 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.868 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -68.4 -45.55 72.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.423 179.451 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.32 -39.87 92.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.648 179.873 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.797 0.332 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.4 -37.97 79.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.008 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t -58.07 -42.5 83.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.208 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.048 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -65.33 -50.95 63.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.995 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -26.79 69.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.315 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -70.12 -49.11 54.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.591 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.73 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.4 -42.67 71.35 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 179.012 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -58.44 -42.04 86.47 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.656 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.06 -46.15 88.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.453 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.412 ' HG2' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -60.38 -31.72 70.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.403 179.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.799 HG22 ' CD2' ' A' ' 58' ' ' LEU . 47.6 t -63.64 -48.05 88.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.36 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.62 -41.31 81.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -69.15 -35.23 76.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.315 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.2 mt -93.38 6.95 46.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.525 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.673 HG22 ' O ' ' A' ' 17' ' ' ILE . 39.1 mm -142.31 66.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-O 121.782 0.801 . . . . 0.0 109.98 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -51.43 -31.57 23.5 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.044 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.73 170.66 11.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.719 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.01 -30.13 9.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.95 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.96 -50.26 72.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.014 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.4 ' HB2' HG23 ' A' ' 17' ' ' ILE . 8.6 mt-10 -50.72 -34.59 27.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.36 0.6 . . . . 0.0 109.397 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 33.6 mttt -71.75 -35.59 70.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.935 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.49 -42.55 99.57 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.19 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.879 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -64.72 -44.6 89.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.403 179.491 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.676 HD12 HG21 ' A' ' 49' ' ' VAL . 0.5 OUTLIER -59.52 -36.51 76.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.711 179.637 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 12.8 m-30 -64.19 -48.52 75.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.617 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.32 -38.64 80.8 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.784 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.879 HG23 ' O ' ' A' ' 25' ' ' TYR . 11.5 t -60.86 -52.54 60.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.08 0.467 . . . . 0.0 110.793 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.702 HD21 HD11 ' A' ' 62' ' ' ILE . 28.5 mt -59.58 -42.97 93.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.317 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.98 -36.71 70.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.474 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 1.8 mmt -63.56 -48.37 77.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.105 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.623 ' HB3' HD21 ' B' ' 101' ' ' LEU . 0.1 OUTLIER -53.39 -39.44 64.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.0 179.634 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.443 ' HD2' HD23 ' B' ' 101' ' ' LEU . 1.0 OUTLIER -74.85 -46.13 38.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.84 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.474 ' HG2' ' HA ' ' A' ' 32' ' ' MET . 7.4 pt20 -77.54 -52.68 8.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -178.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.4 p -92.78 -31.76 14.92 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.521 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 4.7 mmt 63.77 31.19 14.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.979 0.419 . . . . 0.0 110.79 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD2' ' HB3' ' A' ' 40' ' ' ALA . 2.2 t70 -104.87 118.51 36.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.917 ' O ' HG23 ' A' ' 43' ' ' VAL . 20.6 t -77.95 -14.61 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.463 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.455 ' HB3' ' OD2' ' A' ' 38' ' ' ASP . . . -76.07 -34.07 59.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 110.324 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.3 t -72.61 -37.76 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.203 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.541 ' O ' HD12 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -65.24 -44.41 88.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.937 179.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.917 HG23 ' O ' ' A' ' 39' ' ' VAL . 56.5 t -54.56 -43.66 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-O 120.796 0.332 . . . . 0.0 111.2 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.38 -56.41 15.64 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.688 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.507 ' HB3' HG22 ' A' ' 29' ' ' VAL . 1.8 m-20 -59.43 -52.19 66.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.866 0.365 . . . . 0.0 111.1 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.663 HD23 ' CD1' ' A' ' 50' ' ' ILE . 0.7 OUTLIER -50.42 -45.01 55.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.073 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.47 ' O ' ' N ' ' A' ' 51' ' ' ASN . 6.0 mttp -57.62 -48.39 79.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.118 0.485 . . . . 0.0 110.704 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 45' ' ' ASP . 10.8 mt -54.1 -37.56 64.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.676 HG21 HD12 ' A' ' 26' ' ' LEU . 10.4 p -101.04 3.47 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.332 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.902 HG23 ' O ' ' A' ' 55' ' ' ARG . 61.4 mt -139.18 27.86 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-O 121.305 0.574 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.47 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -88.6 16.86 6.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.72 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.414 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 18.9 mm-40 -128.94 142.87 46.59 Favored Pre-proline 0 C--N 1.335 -0.046 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.579 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 56' ' ' LEU . 87.1 Cg_exo -45.68 -39.16 17.88 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.254 1.97 . . . . 0.0 111.927 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -69.12 -34.84 75.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.719 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.902 ' O ' HG23 ' A' ' 50' ' ' ILE . 46.8 mtt85 -91.78 -9.71 42.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.91 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.491 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.5 mt -55.28 -46.12 99.74 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.651 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.47 -25.69 2.34 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.78 2.32 . . . . 0.0 113.523 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.799 ' CD2' HG22 ' A' ' 13' ' ' VAL . 3.4 mt -73.81 -34.15 64.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.85 0.357 . . . . 0.0 111.03 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.553 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -59.93 -50.86 72.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.436 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 5.0 t0 -75.2 -31.16 60.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.73 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.85 -53.67 54.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.052 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.702 HD11 HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -66.15 -36.78 78.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.906 0.384 . . . . 0.0 111.75 -179.571 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.402 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -35.51 -61.24 0.54 Allowed Pre-proline 0 N--CA 1.469 0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.294 -179.234 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.436 ' CD ' ' O ' ' A' ' 60' ' ' ASP . 75.8 Cg_exo -34.75 -33.98 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.511 2.807 . . . . 0.0 113.467 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.503 HD11 HG21 ' B' ' 104' ' ' VAL . 15.1 mt -65.2 -53.97 36.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.596 0.712 . . . . 0.0 109.525 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -46.41 136.64 7.13 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.135 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -67.18 165.7 25.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.448 2.098 . . . . 0.0 112.028 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 72' ' ' VAL . 3.9 tp -51.13 -50.37 59.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.174 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -58.43 8.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.919 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.547 ' HB2' HG23 ' A' ' 66' ' ' ILE . 18.2 m170 -62.05 -25.79 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.397 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.28 -42.33 99.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.017 0.437 . . . . 0.0 110.047 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 68' ' ' LEU . 35.1 t -67.74 -44.74 85.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.424 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -67.22 -33.76 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.408 ' OH ' ' CD2' ' A' ' 59' ' ' PHE . 50.8 t80 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.328 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.498 ' O ' HG23 ' B' ' 104' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.753 0.311 . . . . 0.0 111.05 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.623 HD21 ' HB3' ' A' ' 33' ' ' TYR . 3.3 tp -56.18 -52.62 63.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.986 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.479 ' HA ' HD21 ' B' ' 105' ' ' LEU . 18.2 tttp -63.07 -31.56 72.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.24 -44.66 91.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.323 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.048 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.7 t -66.08 -54.2 29.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.227 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.674 HD12 ' N ' ' B' ' 106' ' ' GLU . 4.4 pp -61.75 -32.88 73.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . 0.674 ' N ' HD12 ' B' ' 105' ' ' LEU . 46.3 tt0 -73.96 -40.35 63.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.717 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 179.901 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.721 0.296 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.78 -34.24 71.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.765 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -66.44 -35.1 74.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.75 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.99 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -70.01 -50.26 43.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.975 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -26.78 68.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.249 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.53 -49.11 51.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.389 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.66 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -69.55 -43.99 71.82 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.058 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.668 HH21 HG11 ' A' ' 13' ' ' VAL . 5.1 tpm_? -59.07 -40.82 86.38 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.581 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -59.33 -42.49 91.58 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.831 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.6 mttp -60.39 -37.23 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.272 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.795 HG13 HD22 ' A' ' 58' ' ' LEU . 41.9 t -59.9 -48.93 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -57.62 -39.07 76.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.219 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -69.05 -32.45 71.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.481 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.0 mt -100.42 8.53 43.54 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.529 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.693 HG22 ' O ' ' A' ' 17' ' ' ILE . 35.3 mm -147.02 68.52 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.702 0.763 . . . . 0.0 110.051 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -58.78 -33.37 70.24 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.891 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -72.72 139.15 47.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.742 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -75.46 -28.87 59.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.033 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -52.65 64.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.032 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.604 ' HB2' HG23 ' A' ' 17' ' ' ILE . 25.7 mt-10 -50.98 -34.76 30.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 17.7 mttp -72.21 -34.25 68.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.887 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -61.61 -41.8 97.98 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.188 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.906 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -67.76 -42.08 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.291 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.5 mt -63.1 -39.01 93.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.532 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.401 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.7 m-85 -62.67 -44.48 96.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.63 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -63.5 -44.51 94.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.547 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 25' ' ' TYR . 21.6 t -59.46 -46.49 92.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.07 HD21 HD11 ' A' ' 62' ' ' ILE . 3.8 mt -59.7 -44.41 93.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.426 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.86 -36.24 72.07 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.508 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.428 ' O ' ' N ' ' A' ' 36' ' ' THR . 25.8 mtp -63.35 -48.94 75.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.139 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.454 ' CE2' HG13 ' A' ' 66' ' ' ILE . 0.1 OUTLIER -53.54 -42.55 67.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.878 0.37 . . . . 0.0 110.883 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -44.55 49.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.869 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -77.34 -55.01 5.76 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.428 ' N ' ' O ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -92.2 -43.39 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -178.666 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.442 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.5 ttt 74.51 32.98 0.88 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.853 0.359 . . . . 0.0 110.652 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.707 ' O ' HD12 ' A' ' 42' ' ' LEU . 9.9 p30 -98.14 115.92 29.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.555 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.895 ' O ' HG23 ' A' ' 43' ' ' VAL . 20.8 t -79.2 -16.63 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.447 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.88 -37.68 47.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.017 0.437 . . . . 0.0 110.478 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.533 HG21 ' OD2' ' A' ' 38' ' ' ASP . 25.4 t -73.56 -34.06 40.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.279 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.707 HD12 ' O ' ' A' ' 38' ' ' ASP . 0.2 OUTLIER -69.51 -41.37 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.803 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 39' ' ' VAL . 95.0 t -60.0 -40.06 82.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.639 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.17 -57.27 12.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.449 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.55 -48.66 76.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.871 0.367 . . . . 0.0 110.908 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.56 ' HG ' HG11 ' A' ' 29' ' ' VAL . 65.6 mt -50.52 -41.93 54.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.874 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -62.15 -44.94 95.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.105 0.478 . . . . 0.0 110.435 179.621 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -54.95 -37.05 65.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.76 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.693 HG13 HG13 ' A' ' 50' ' ' ILE . 15.0 p -101.12 -0.78 10.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.394 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.882 HG23 ' O ' ' A' ' 55' ' ' ARG . 49.0 mt -136.64 29.46 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.083 0.468 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -89.31 16.53 7.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.674 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -131.01 143.7 50.52 Favored Pre-proline 0 C--N 1.333 -0.112 0 CA-C-O 120.561 0.22 . . . . 0.0 110.435 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.521 ' HA ' HD12 ' A' ' 56' ' ' LEU . 86.7 Cg_exo -46.25 -39.49 21.19 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.343 2.029 . . . . 0.0 111.974 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 m -69.21 -33.55 73.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.624 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.882 ' O ' HG23 ' A' ' 50' ' ' ILE . 11.2 mtp180 -89.87 -12.04 40.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.477 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.8 mt -53.78 -46.07 98.56 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 94.1 Cg_exo -43.72 -27.21 1.44 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.706 2.271 . . . . 0.0 113.736 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.795 HD22 HG13 ' A' ' 13' ' ' VAL . 14.9 mt -73.72 -34.23 64.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 111.139 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.72 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -65.96 -45.84 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 110.888 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.32 -31.48 60.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.832 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.536 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.35 -63.06 1.35 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.732 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 1.07 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.71 -30.86 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.971 0.415 . . . . 0.0 111.648 -179.619 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.498 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 25.1 ttp180 -40.18 -60.26 1.54 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.498 ' CD ' ' HB3' ' A' ' 63' ' ' ARG . 6.7 Cg_endo -48.76 -25.64 8.5 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.69 2.26 . . . . 0.0 113.28 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.66 HD11 ' CE2' ' A' ' 9' ' ' PHE . 26.1 mt -65.57 -45.25 84.02 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.568 0.699 . . . . 0.0 109.575 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.637 HG23 ' HB2' ' A' ' 70' ' ' HIS . 1.3 mp -50.7 136.43 25.65 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.149 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -61.39 165.78 12.47 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.576 2.184 . . . . 0.0 112.188 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.511 ' O ' HG23 ' A' ' 72' ' ' VAL . 16.8 mt -52.01 -49.76 62.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.467 -179.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -56.75 -61.35 2.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.162 0.506 . . . . 0.0 110.681 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.637 ' HB2' HG23 ' A' ' 66' ' ' ILE . 16.0 m170 -60.23 -26.66 66.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -60.81 -46.95 88.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.041 0.448 . . . . 0.0 109.896 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 68' ' ' LEU . 20.0 t -62.23 -45.0 99.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.935 179.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.12 -31.35 72.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.32 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.405 ' OH ' HD13 ' A' ' 46' ' ' LEU . 4.2 t80 . . . . . 0 C--N 1.332 -0.18 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.67 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.411 HD22 ' CD2' ' A' ' 65' ' ' LEU . 2.7 mt . . . . . 0 N--CA 1.463 0.182 0 CA-C-O 120.715 0.293 . . . . 0.0 111.253 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 26.3 tp -53.35 -52.75 58.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.959 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -56.68 -31.66 64.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -67.63 -38.41 83.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.977 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.99 HG22 ' HB1' ' A' ' 6' ' ' ALA . 23.9 t -70.85 -34.93 57.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.482 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.533 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.5 OUTLIER -67.26 -45.62 76.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.425 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -73.61 -33.71 64.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.726 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.794 179.984 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.865 0.364 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -59.28 -33.52 71.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.9 t -61.61 -39.19 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.0 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.52 -50.96 56.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.183 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -66.68 -26.88 67.25 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.069 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -71.63 -48.93 44.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.372 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.918 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.32 -44.04 72.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.016 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.47 -41.13 89.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.838 178.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -58.46 -43.0 88.69 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.8 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -60.7 -35.47 76.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 1.056 HG13 HD21 ' A' ' 58' ' ' LEU . 54.8 t -60.71 -48.46 88.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.465 179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.62 -41.33 81.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.191 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -69.14 -32.61 72.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.472 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.7 mt -97.99 7.47 46.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.547 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.658 HG22 ' O ' ' A' ' 17' ' ' ILE . 35.6 mm -146.59 68.63 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.931 0 CA-C-O 121.671 0.748 . . . . 0.0 109.861 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -55.92 -33.48 64.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.871 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -71.25 159.63 34.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.695 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.0 -29.78 15.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.975 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.54 -52.67 64.55 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.551 ' HB2' HG23 ' A' ' 17' ' ' ILE . 12.5 mt-10 -50.8 -34.77 28.93 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -72.88 -34.17 66.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.944 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -64.88 -44.67 88.92 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.249 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.883 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.8 -40.18 94.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.249 179.371 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.603 HD11 HD22 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -64.12 -39.73 94.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.492 179.595 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -60.89 -43.57 98.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.481 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -64.81 -36.29 83.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.547 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 25' ' ' TYR . 28.0 t -65.62 -45.41 92.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.019 HD21 HD11 ' A' ' 62' ' ' ILE . 12.9 mt -65.52 -43.3 90.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.522 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -63.63 -31.11 72.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.42 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -52.1 35.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.378 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.565 ' CG ' HD12 ' A' ' 42' ' ' LEU . 14.8 t80 -57.55 -33.88 68.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.996 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -74.57 -41.6 60.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.994 0.426 . . . . 0.0 111.018 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -77.45 -54.99 5.76 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.38 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 p -81.67 -28.79 33.37 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.518 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.0 mmt 64.13 35.46 10.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 110.607 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -118.21 124.23 47.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.883 ' O ' HG23 ' A' ' 43' ' ' VAL . 4.7 t -77.63 -7.37 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.377 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -38.56 47.99 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.05 0.453 . . . . 0.0 110.269 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.25 -33.98 60.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.99 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.89 HD22 HD11 ' A' ' 46' ' ' LEU . 1.2 mt -66.82 -49.77 64.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.884 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 39' ' ' VAL . 29.0 t -58.68 -42.87 86.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.477 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.35 -58.29 14.1 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.848 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -66.13 -40.9 91.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.258 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.89 HD11 HD22 ' A' ' 42' ' ' LEU . 20.7 mt -51.51 -47.44 63.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.096 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.48 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.76 -46.84 77.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 0.0 110.702 179.685 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.6 mt -53.57 -41.18 66.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.841 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.634 HG13 HG13 ' A' ' 50' ' ' ILE . 14.3 p -101.19 8.44 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.354 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.862 HG23 ' O ' ' A' ' 55' ' ' ARG . 71.2 mt -144.88 28.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.236 0.541 . . . . 0.0 111.094 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 47' ' ' LYS . 14.5 p30 -90.18 15.32 10.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.559 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -128.79 150.86 76.13 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.07 -39.21 70.75 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.38 2.053 . . . . 0.0 111.558 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.6 p -69.58 -34.01 73.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.806 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.862 ' O ' HG23 ' A' ' 50' ' ' ILE . 45.6 mtt180 -90.22 -12.21 38.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.69 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.485 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -53.03 -46.33 97.7 Favored Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 83.4 Cg_exo -46.65 -24.92 3.17 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.806 2.337 . . . . 0.0 113.56 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.056 HD21 HG13 ' A' ' 13' ' ' VAL . 27.8 mt -67.23 -35.3 79.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.709 0.29 . . . . 0.0 111.189 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -45.01 95.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.519 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.43 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 1.3 t0 -75.2 -31.12 60.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.848 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.918 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.25 -54.69 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.093 -179.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 1.019 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -71.19 -38.1 69.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.581 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 2.0 tmm_? -36.94 -55.76 1.55 Allowed Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.581 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 81.5 Cg_exo -41.16 -34.23 1.55 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.766 2.31 . . . . 0.0 112.958 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.596 HD12 HG13 ' A' ' 62' ' ' ILE . 24.3 mt -65.31 -51.28 61.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.391 0.615 . . . . 0.0 110.338 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.497 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -44.78 134.75 4.84 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.186 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.17 165.55 1.33 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.636 2.224 . . . . 0.0 112.361 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.7 tp -55.8 -55.51 31.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.952 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.07 -53.61 56.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.034 0.445 . . . . 0.0 110.403 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.497 ' CB ' HG23 ' A' ' 66' ' ' ILE . 19.2 m170 -59.62 -31.02 69.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.324 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -45.64 92.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.3 179.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.6 t -61.53 -47.76 91.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.096 179.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.09 -29.19 69.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.199 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.62 ' OH ' HD13 ' A' ' 46' ' ' LEU . 16.7 t80 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.651 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mt . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.906 0.384 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.813 HD11 HD23 ' A' ' 30' ' ' LEU . 11.7 tp -54.43 -52.85 60.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.827 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -57.75 -31.63 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.036 179.745 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.55 -41.02 93.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.145 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.0 HG22 ' HB1' ' A' ' 6' ' ' ALA . 25.8 t -70.47 -36.12 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.505 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.516 HD22 ' HB3' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -62.57 -45.65 91.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.91 0.386 . . . . 0.0 110.214 179.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -33.82 71.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.752 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.879 179.977 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.413 ' NH1' ' HB3' ' A' ' 3' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.465 0.321 0 CA-C-O 120.683 0.278 . . . . 0.0 111.541 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -59.05 -45.15 91.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.833 0.349 . . . . 0.0 111.029 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -58.98 -40.77 81.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.109 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.53 -49.03 58.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.878 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -66.11 -26.76 67.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.111 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -71.06 -49.12 48.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.375 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.724 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.25 -44.39 72.04 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.083 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.45 85.16 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.0 t-160 -57.63 -42.43 83.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.561 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -59.98 -36.78 77.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.911 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.998 HG22 HD22 ' A' ' 58' ' ' LEU . 48.8 t -58.56 -49.73 81.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.219 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -57.68 -38.25 74.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -68.93 -39.14 79.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.469 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.466 ' O ' HD13 ' A' ' 17' ' ' ILE . 16.3 mt -93.02 7.44 44.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.434 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.644 HG22 ' O ' ' A' ' 17' ' ' ILE . 42.4 mm -148.11 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.621 0.724 . . . . 0.0 110.141 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.85 -35.65 69.09 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.951 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.97 174.36 1.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -107.49 -33.29 7.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.935 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -51.48 69.24 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.986 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.411 ' HB2' HG23 ' A' ' 17' ' ' ILE . 19.6 mt-10 -50.8 -34.82 29.14 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.448 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 4.8 mttm -71.8 -34.61 69.52 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.97 178.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.45 -44.47 96.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.169 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.829 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -64.94 -41.71 95.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.357 179.429 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.58 -42.76 93.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 15.8 m-85 -61.46 -44.44 97.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.521 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.42 -32.92 72.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.846 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.966 HG12 HD23 ' A' ' 42' ' ' LEU . 21.5 t -66.07 -51.83 55.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.905 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.045 HD21 HD11 ' A' ' 62' ' ' ILE . 32.2 mt -62.05 -36.2 80.91 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.47 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -62.35 -38.81 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.385 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.437 ' O ' HG23 ' A' ' 36' ' ' THR . 10.3 mmm -65.19 -48.04 74.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.54 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.487 ' CD1' HD12 ' A' ' 42' ' ' LEU . 11.0 t80 -57.35 -33.67 68.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -70.1 -52.61 22.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.219 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -77.46 -54.96 5.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.918 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 32' ' ' MET . 5.5 p -66.87 -38.72 86.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.893 -179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.423 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.1 mmt 64.67 28.87 13.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.84 0.352 . . . . 0.0 110.716 -179.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.16 127.13 53.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.866 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.8 t -75.26 -7.55 10.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.168 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.9 -36.47 56.64 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.008 0.432 . . . . 0.0 110.199 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.82 -33.97 54.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.966 HD23 HG12 ' A' ' 29' ' ' VAL . 2.3 mt -67.27 -47.77 69.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.833 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 39' ' ' VAL . 31.3 t -57.72 -45.65 86.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.555 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.84 -57.39 17.71 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.049 -179.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.801 ' HB3' HG22 ' A' ' 29' ' ' VAL . 9.0 m-20 -64.88 -42.93 94.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.705 0.288 . . . . 0.0 111.28 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.715 HD11 HD22 ' A' ' 42' ' ' LEU . 26.9 mt -50.42 -53.29 30.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.5 mttt -53.18 -48.36 68.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.873 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.9 mt -49.96 -42.95 49.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.083 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.9 p -101.09 5.72 10.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.427 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.861 HG23 ' O ' ' A' ' 55' ' ' ARG . 41.6 mt -138.19 28.39 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.329 0.585 . . . . 0.0 110.941 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 12.6 m-20 -84.84 13.68 5.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.907 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -126.31 143.03 44.55 Favored Pre-proline 0 N--CA 1.457 -0.085 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.633 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 56' ' ' LEU . 83.2 Cg_exo -46.86 -38.92 23.93 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.281 1.987 . . . . 0.0 111.801 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.4 t -69.3 -32.82 72.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.582 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.861 ' O ' HG23 ' A' ' 50' ' ' ILE . 91.5 mtt180 -90.12 -12.69 37.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.547 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.495 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.5 mt -54.42 -45.98 99.2 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.495 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 98.7 Cg_exo -44.2 -30.9 3.78 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.788 2.325 . . . . 0.0 113.69 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.998 HD22 HG22 ' A' ' 13' ' ' VAL . 16.7 mt -64.6 -39.86 94.47 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.686 0.279 . . . . 0.0 111.272 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -54.5 -47.26 73.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.006 0.432 . . . . 0.0 110.627 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -75.31 -31.26 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.715 179.475 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.724 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -61.81 -57.02 13.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.907 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 1.045 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.52 -37.41 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.043 -179.177 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.442 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.3 mtp85 -36.44 -64.58 0.36 Allowed Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 73.7 Cg_exo -36.49 -33.85 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.234 2.623 . . . . 0.0 113.221 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.676 HD12 HG13 ' A' ' 62' ' ' ILE . 24.4 mt -65.13 -51.28 62.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.447 0.641 . . . . 0.0 110.117 179.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.506 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -45.37 135.32 5.62 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.304 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.16 165.67 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.667 2.244 . . . . 0.0 112.336 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.4 mt -56.03 -57.06 13.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.117 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.466 ' O ' HG12 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -59.68 -46.58 88.63 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.706 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.506 ' CB ' HG23 ' A' ' 66' ' ' ILE . 23.2 m170 -65.37 -25.48 67.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.476 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.46 -55.03 35.71 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.569 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.5 p -62.83 -37.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.385 179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.2 -31.69 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.362 179.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.581 ' OH ' HD13 ' A' ' 46' ' ' LEU . 11.4 t80 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.477 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.882 0.372 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.661 HD12 HD13 ' A' ' 65' ' ' LEU . 21.9 tp -53.99 -52.59 60.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.797 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -31.7 67.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.704 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.32 -38.81 91.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.883 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.109 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.1 t -69.66 -41.54 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.059 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.2 mt -57.61 -44.17 85.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.29 0.567 . . . . 0.0 109.909 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -73.66 -32.81 64.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.955 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.929 -179.0 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.861 0.362 . . . . 0.0 111.024 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.95 -42.79 99.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.813 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.21 -35.07 59.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.077 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.94 -51.05 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.004 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.28 -26.88 67.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.198 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.74 -45.97 60.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.456 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -70.7 -44.76 66.3 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.67 -42.77 89.25 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.15 -40.28 89.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.937 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -62.28 -36.27 81.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.06 179.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.711 HG22 HD22 ' A' ' 58' ' ' LEU . 47.2 t -59.41 -52.06 65.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.228 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -57.47 -35.22 69.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.167 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -69.01 -39.8 79.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.599 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 mt -98.12 11.17 38.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.557 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.66 HG22 ' O ' ' A' ' 17' ' ' ILE . 36.0 mm -149.44 69.12 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-O 121.692 0.758 . . . . 0.0 110.143 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -60.42 -36.77 78.95 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.739 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -62.08 140.28 58.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.704 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.88 -36.61 56.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.36 65.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.852 0.358 . . . . 0.0 111.16 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.537 ' HB2' HG23 ' A' ' 17' ' ' ILE . 47.3 mt-10 -50.68 -34.75 27.85 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.417 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 9.9 mtpt -73.26 -35.34 66.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.847 178.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.09 -39.22 94.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.007 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.884 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -68.0 -43.41 78.94 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.311 179.366 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -62.87 -45.46 92.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.677 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.4 m-85 -60.93 -37.06 80.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.675 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.78 -32.99 73.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.592 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 25' ' ' TYR . 21.5 t -72.0 -39.45 66.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.837 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.665 HD21 HD11 ' A' ' 62' ' ' ILE . 16.5 mt -69.89 -40.71 75.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.535 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -37.27 81.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.333 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.32 -46.03 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.13 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.735 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.4 t80 -60.15 -35.66 75.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.437 ' CE1' ' HE3' ' B' ' 102' ' ' LYS . 42.2 t-80 -74.58 -44.67 49.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.326 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -77.51 -54.98 5.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.162 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.3 p -74.17 -23.09 59.18 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 18.7 mmt 61.24 22.25 12.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.676 0.274 . . . . 0.0 110.798 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.616 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -98.47 116.45 30.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.707 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.752 ' HA ' HD23 ' A' ' 42' ' ' LEU . 21.6 t -80.15 -21.41 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.187 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.2 -32.46 56.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.7 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.616 HG23 ' HB3' ' A' ' 38' ' ' ASP . 39.2 t -73.4 -42.32 56.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.801 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 39' ' ' VAL . 0.4 OUTLIER -69.11 -36.15 77.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.701 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 39' ' ' VAL . 54.1 t -66.81 -43.16 89.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.023 0.44 . . . . 0.0 110.338 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.39 -56.05 27.23 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.334 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -60.99 -42.26 98.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.94 0.4 . . . . 0.0 110.719 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.804 HD22 ' CD1' ' A' ' 50' ' ' ILE . 12.2 mt -50.44 -43.74 55.18 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.743 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.3 mmtt -56.69 -50.59 71.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.245 0.545 . . . . 0.0 110.58 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -38.5 54.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.912 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 49' ' ' VAL . 12.5 p -101.15 5.49 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.416 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.856 HG23 ' O ' ' A' ' 55' ' ' ARG . 69.2 mt -141.31 29.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.272 0.558 . . . . 0.0 110.826 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 47' ' ' LYS . 16.5 m-20 -82.11 9.06 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.413 ' CG ' ' CD ' ' A' ' 55' ' ' ARG . 2.8 pt-20 -132.61 153.93 81.31 Favored Pre-proline 0 N--CA 1.462 0.157 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.367 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.482 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.8 Cg_endo -51.23 -38.25 61.05 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.836 2.357 . . . . 0.0 112.168 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -32.47 72.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.411 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.856 ' O ' HG23 ' A' ' 50' ' ' ILE . 14.8 mtp180 -94.47 -10.24 32.96 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.441 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.595 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.4 mt -54.13 -54.2 50.14 Favored Pre-proline 0 C--N 1.332 -0.161 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.595 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.6 Cg_endo -41.44 -24.89 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.123 2.549 . . . . 0.0 113.841 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.711 HD22 HG22 ' A' ' 13' ' ' VAL . 17.6 mt -73.74 -31.49 63.38 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.312 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.785 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -72.36 -41.29 66.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 110.963 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.444 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 3.3 m-20 -75.03 -30.92 61.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.654 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.826 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.81 -60.08 2.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.009 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.665 HD11 HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.06 -35.84 59.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.929 -179.452 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.436 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.2 ttt-85 -41.82 -65.64 0.49 Allowed Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.126 -179.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.464 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.1 Cg_exo -35.57 -30.75 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.337 2.691 . . . . 0.0 113.757 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.849 HD11 ' CE2' ' A' ' 9' ' ' PHE . 25.0 mt -64.94 -50.78 65.07 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.468 0.652 . . . . 0.0 109.784 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.564 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.6 mp -41.59 127.94 2.37 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.452 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.454 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 52.9 Cg_exo -55.21 165.8 2.75 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.66 2.24 . . . . 0.0 112.175 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.502 ' O ' HG23 ' A' ' 72' ' ' VAL . 1.5 mp -52.19 -50.18 62.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.287 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -57.74 -60.6 3.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.168 0.509 . . . . 0.0 110.39 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.564 ' CB ' HG23 ' A' ' 66' ' ' ILE . 44.7 m170 -58.76 -24.23 61.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.378 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -44.43 83.36 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.087 0.47 . . . . 0.0 109.82 179.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 68' ' ' LEU . 28.6 t -61.58 -42.96 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.736 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 -31.74 70.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.147 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.467 ' HE1' HD11 ' A' ' 42' ' ' LEU . 4.3 t80 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.546 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.508 ' O ' HG23 ' B' ' 104' ' ' VAL . 3.4 mt . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.882 0.372 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.683 ' HA ' HD13 ' A' ' 65' ' ' LEU . 2.1 pt? -52.24 -41.84 63.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.813 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.511 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 20.9 tttt -60.32 -38.84 84.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -34.41 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.722 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 1.077 HG22 ' HB1' ' A' ' 6' ' ' ALA . 2.8 t -70.97 -34.79 56.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.496 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.7 OUTLIER -66.67 -45.62 78.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.961 0.41 . . . . 0.0 110.065 179.195 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -69.87 -34.33 73.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.642 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.625 179.694 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 53.0 mtm-85 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.83 0.348 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -59.3 -36.54 75.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.96 -39.78 78.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.212 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.27 -51.18 56.09 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.085 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 3.3 ttp-105 -65.77 -26.79 67.88 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.303 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -72.6 -48.74 37.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.47 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.808 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -68.86 -42.51 76.96 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.142 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.625 HH21 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -61.26 -42.77 99.19 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.893 178.749 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 18.8 t-160 -56.85 -41.44 77.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.176 0.512 . . . . 0.0 109.674 178.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -60.48 -38.05 83.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.018 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 1.012 HG13 HD21 ' A' ' 58' ' ' LEU . 57.5 t -57.68 -50.06 78.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.469 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -57.72 -37.81 74.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.105 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.593 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.6 mt -97.43 8.83 43.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.528 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.634 HG22 ' O ' ' A' ' 17' ' ' ILE . 37.3 mm -148.96 69.13 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-O 121.619 0.723 . . . . 0.0 110.092 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -33.46 69.6 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.921 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.71 175.58 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.965 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -110.25 -29.76 8.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.959 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.53 -52.82 61.95 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.419 ' O ' HD12 ' A' ' 26' ' ' LEU . 6.4 mt-10 -50.84 -34.88 29.69 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 11.2 mttt -72.95 -34.14 66.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.86 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -62.38 -42.65 99.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.041 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.79 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -66.93 -40.93 87.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.281 179.422 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 22' ' ' GLU . 1.9 mt -61.46 -38.22 86.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.642 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 19.9 m-85 -65.48 -43.97 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.3 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.756 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 25' ' ' TYR . 17.0 t -65.1 -50.18 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.905 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.069 HD21 HD11 ' A' ' 62' ' ' ILE . 5.9 mt -63.83 -33.5 75.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.426 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -67.02 -41.6 86.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.66 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.83 -43.55 92.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.411 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 37' ' ' MET . 1.7 t80 -60.79 -38.41 85.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.841 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -74.88 -46.79 33.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.869 0.366 . . . . 0.0 111.323 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -54.74 6.0 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.2 -34.71 12.13 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.496 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.1 mtt 72.74 32.03 1.53 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.808 0.337 . . . . 0.0 110.793 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.474 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -84.37 115.1 22.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.709 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.9 t -77.76 -23.71 14.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.8 -37.15 30.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 38' ' ' ASP . 24.8 t -73.55 -35.86 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.664 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.789 ' HA ' HG13 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -73.96 -38.92 64.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.014 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.775 HG22 ' CE1' ' A' ' 74' ' ' TYR . 75.7 t -69.82 -43.04 80.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.936 0.398 . . . . 0.0 110.521 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.77 -50.01 72.29 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.404 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.741 ' HA ' HD12 ' A' ' 48' ' ' LEU . 75.4 m-20 -62.95 -47.34 83.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.376 . . . . 0.0 110.933 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.786 ' HG ' HG11 ' A' ' 29' ' ' VAL . 20.4 mt -50.8 -42.33 58.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 4.2 mtpt -58.48 -51.73 68.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.48 . . . . 0.0 110.811 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.741 HD12 ' HA ' ' A' ' 45' ' ' ASP . 7.7 mt -53.04 -35.54 59.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.941 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.588 HG13 HG13 ' A' ' 50' ' ' ILE . 14.7 p -100.97 3.21 10.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.36 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.88 HG23 ' O ' ' A' ' 55' ' ' ARG . 54.7 mt -139.09 27.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.131 0.491 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -85.54 16.09 4.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.812 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -127.58 140.97 39.51 Favored Pre-proline 0 CA--C 1.523 -0.059 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.59 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HA ' HD12 ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.33 -38.88 15.78 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.378 2.052 . . . . 0.0 111.881 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 t -69.32 -34.76 75.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.716 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.88 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -89.72 -13.88 35.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.775 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.64 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 12.8 mt -49.0 -51.62 54.09 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.64 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 5.1 Cg_exo -39.97 -28.33 0.25 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.242 2.628 . . . . 0.0 113.893 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.012 HD21 HG13 ' A' ' 13' ' ' VAL . 9.3 mt -63.48 -38.58 91.7 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.644 0.259 . . . . 0.0 111.102 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.481 ' CE1' ' CZ ' ' A' ' 74' ' ' TYR . 0.2 OUTLIER -59.82 -44.0 94.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 0.0 110.674 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -75.1 -31.58 61.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.692 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.808 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.82 -60.25 3.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.391 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 1.069 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -66.93 -30.01 48.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.829 -179.645 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.474 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 16.1 ttp180 -40.21 -58.08 2.52 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.2 Cg_endo -48.48 -30.0 14.92 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.706 2.271 . . . . 0.0 113.125 -178.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.568 HD12 ' CG1' ' A' ' 62' ' ' ILE . 12.9 mt -65.37 -49.61 68.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.482 0.658 . . . . 0.0 109.872 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.484 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -47.12 133.73 9.08 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.159 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.33 165.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.488 2.125 . . . . 0.0 112.14 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.6 tp -56.46 -57.79 10.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.871 0.367 . . . . 0.0 110.928 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.7 pttt -58.97 -48.93 79.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.081 0.467 . . . . 0.0 110.429 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.484 ' CB ' HG23 ' A' ' 66' ' ' ILE . 38.3 m170 -60.73 -29.21 69.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.386 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.66 -42.3 91.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.059 0.457 . . . . 0.0 110.241 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 31.1 t -62.45 -45.35 98.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.362 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.33 -31.88 69.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.458 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.775 ' CE1' HG22 ' A' ' 43' ' ' VAL . 63.2 t80 . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.731 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.483 ' HB3' HD22 ' A' ' 65' ' ' LEU . 30.9 mt . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.673 0.273 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 101' ' ' LEU . . . . . 0.538 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.6 OUTLIER -51.76 -53.2 42.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.855 -179.842 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 pttt -61.2 -31.7 71.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.72 -40.39 94.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.945 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 104' ' ' VAL . . . . . 0.773 HG11 ' CZ ' ' A' ' 9' ' ' PHE . 2.4 t -71.16 -46.5 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.458 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . 0.624 HD21 ' HB3' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -65.08 -45.5 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.957 0.408 . . . . 0.0 110.478 179.845 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -66.03 -37.83 86.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.075 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 . . . . . 0 C--N 1.327 -0.411 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.34 -179.775 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 ptp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.868 0.366 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.528 ' HB3' HD21 ' B' ' 100' ' ' LEU . 1.1 t70 -130.71 34.4 4.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.88 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tpp85 -82.48 -34.17 28.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.973 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.03 -33.73 73.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.854 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.7 t -64.24 -35.58 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.076 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.71 -51.0 38.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.995 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.31 -26.84 68.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.229 179.313 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -70.76 -47.69 58.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.475 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.728 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.58 -44.53 67.18 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.761 ' CZ ' HD22 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -55.93 -43.87 77.82 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.736 178.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.412 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 9.6 m170 -60.13 -41.14 92.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.085 0.469 . . . . 0.0 109.952 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -61.22 -37.55 83.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.129 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.861 HG22 ' CD2' ' A' ' 58' ' ' LEU . 47.0 t -59.97 -49.13 85.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.392 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.66 -37.54 73.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.178 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -68.84 -37.12 78.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.699 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 mt -97.72 8.96 43.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.535 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 17' ' ' ILE . 36.7 mm -149.76 69.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 CA-C-O 121.731 0.777 . . . . 0.0 110.112 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.803 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.83 160.72 16.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.724 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -95.73 -29.42 14.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.969 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.98 -53.64 54.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.002 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.517 ' HB2' HG23 ' A' ' 17' ' ' ILE . 11.0 mt-10 -50.91 -34.84 30.1 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.412 ' O ' ' CG ' ' A' ' 27' ' ' TYR . 8.2 mttm -73.52 -34.78 65.4 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.905 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -65.42 -43.8 89.36 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.15 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.897 ' O ' HG23 ' A' ' 29' ' ' VAL . 5.7 t80 -64.37 -41.3 96.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.205 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.37 -39.85 95.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.359 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.412 ' CG ' ' O ' ' A' ' 23' ' ' LYS . 20.6 m-85 -60.29 -43.8 95.93 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.495 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -64.66 -34.43 78.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.498 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 25' ' ' TYR . 17.5 t -67.82 -43.41 86.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.783 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.037 HD21 HD11 ' A' ' 62' ' ' ILE . 16.1 mt -66.12 -42.51 89.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.628 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -32.93 74.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.624 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.415 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 70.9 mmm -66.66 -47.06 73.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.583 ' CG ' HD12 ' A' ' 42' ' ' LEU . 13.3 t80 -59.37 -40.83 87.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.038 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.575 ' HD2' HD23 ' B' ' 101' ' ' LEU . 4.8 t-80 -67.86 -43.39 79.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.346 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.507 ' HG3' HG23 ' A' ' 36' ' ' THR . 19.4 pt20 -77.24 -50.0 13.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.901 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.507 HG23 ' HG3' ' A' ' 35' ' ' GLN . 22.3 p -78.08 -30.5 49.64 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.425 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.2 mmt 62.64 28.73 16.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.952 0.406 . . . . 0.0 110.718 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -119.53 122.31 41.35 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.962 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.88 ' O ' HG23 ' A' ' 43' ' ' VAL . 14.9 t -78.66 -7.27 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.537 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.0 -36.99 58.96 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.091 0.472 . . . . 0.0 110.22 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.95 -34.03 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.959 179.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.819 HD23 HG12 ' A' ' 29' ' ' VAL . 1.3 mt -65.52 -46.34 80.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.844 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 39' ' ' VAL . 33.4 t -57.54 -45.73 86.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.423 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.91 -58.0 15.91 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.772 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -64.67 -36.35 83.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.933 0.397 . . . . 0.0 111.089 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.587 HD13 ' OH ' ' A' ' 74' ' ' TYR . 13.8 mt -52.89 -55.02 26.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.831 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -54.48 -43.35 71.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.767 179.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.98 -45.78 61.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.788 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 49' ' ' VAL . 13.4 p -100.98 8.42 8.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.342 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.766 ' O ' HG22 ' A' ' 50' ' ' ILE . 60.1 mt -138.51 27.11 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.33 0.586 . . . . 0.0 111.034 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.46 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -85.78 15.91 4.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.803 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -127.65 144.27 50.53 Favored Pre-proline 0 C--O 1.23 0.072 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.427 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.514 ' HA ' HD12 ' A' ' 56' ' ' LEU . 6.5 Cg_endo -48.7 -37.97 36.06 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.347 2.032 . . . . 0.0 111.513 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -69.38 -34.07 74.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.644 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.763 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -90.46 -12.45 37.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.79 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 53' ' ' PRO . 13.8 mt -52.51 -45.86 95.5 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.9 Cg_exo -47.01 -23.92 2.93 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.735 2.29 . . . . 0.0 113.595 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.861 ' CD2' HG22 ' A' ' 13' ' ' VAL . 12.4 mt -73.73 -37.63 65.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.736 0.303 . . . . 0.0 111.322 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.664 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -60.06 -48.83 80.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.908 0.385 . . . . 0.0 111.111 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.402 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -75.22 -30.99 60.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.994 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.728 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -63.73 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.283 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 1.037 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -59.93 -34.24 55.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -41.53 -63.12 0.89 Allowed Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.905 -178.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 87.0 Cg_exo -33.8 -33.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 123.338 2.692 . . . . 0.0 113.541 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.476 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.5 mt -64.91 -53.81 40.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.355 0.598 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.574 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -43.41 132.19 3.59 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.116 179.52 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.86 165.5 10.02 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.618 2.212 . . . . 0.0 112.019 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.442 ' O ' HG23 ' A' ' 72' ' ' VAL . 2.1 tt -51.99 -51.36 57.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.219 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -61.06 2.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 0.0 110.539 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.607 ' HB3' HG21 ' A' ' 39' ' ' VAL . 36.8 m170 -59.21 -23.66 62.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -43.43 86.94 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.116 0.484 . . . . 0.0 110.166 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 68' ' ' LEU . 27.2 t -64.85 -45.51 94.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.374 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.58 -32.98 70.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.473 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.912 ' O ' HG23 ' A' ' 78' ' ' THR . 7.5 t80 -69.87 -46.8 64.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.539 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -61.93 -37.47 84.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.628 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -63.83 -45.24 90.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.704 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.3 mt -65.07 -34.84 79.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.912 HG23 ' O ' ' A' ' 74' ' ' TYR . 14.0 p -77.18 154.17 82.36 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.002 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.51 74.24 1.19 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.717 2.278 . . . . 0.0 112.305 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.8 ttm-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.885 179.989 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.278 0 N-CA-C 112.774 -0.13 . . . . 0.0 112.774 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 56.29 83.56 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.738 0.304 . . . . 0.0 111.12 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.528 HD21 ' HB3' ' A' ' 2' ' ' ASP . 10.6 mt -72.4 -40.84 66.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.027 0.442 . . . . 0.0 110.83 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.62 HD11 HD23 ' A' ' 30' ' ' LEU . 9.5 tp -55.32 -52.66 62.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.597 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.42 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.5 OUTLIER -56.75 -33.41 66.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -64.28 -41.91 96.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.05 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.076 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.9 t -68.69 -36.53 74.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.257 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.471 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.8 OUTLIER -63.5 -45.62 89.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 110.294 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.7 -35.8 81.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.623 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -60.68 -41.4 95.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.455 ' CE2' ' CG ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -68.11 -53.52 24.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.714 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 16.8 mt -51.17 -37.15 44.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.888 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -76.89 -36.67 56.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.383 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.761 HD22 ' CZ ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -68.63 -12.36 61.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.268 178.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 30.7 mmtt -78.91 -76.84 0.19 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.936 0.398 . . . . 0.0 110.793 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.938 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.71 0.29 . . . . 0.0 111.255 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.785 ' HB2' HG23 ' A' ' 5' ' ' VAL . 4.0 m-20 -150.21 164.19 36.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.901 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -41.04 42.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.909 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.45 -33.55 73.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.825 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.785 HG23 ' HB2' ' A' ' 2' ' ' ASP . 62.0 t -61.42 -36.86 75.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.207 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.99 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.04 -51.16 41.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.105 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 3.2 ttt180 -67.17 -26.84 66.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.156 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -72.7 -45.99 55.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.289 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.691 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.76 -43.92 67.79 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.516 ' NH2' HD22 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -57.37 -44.92 84.82 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.768 178.453 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.444 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 4.2 m-70 -58.91 -39.31 81.13 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 121.202 0.525 . . . . 0.0 109.743 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -62.47 -38.1 88.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.282 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.69 HG22 HD22 ' A' ' 58' ' ' LEU . 52.9 t -59.6 -48.21 88.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.512 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -57.59 -42.64 83.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.17 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -69.01 -33.56 73.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.617 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.43 ' O ' HD13 ' A' ' 17' ' ' ILE . 69.5 mt -95.4 6.44 49.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.651 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.645 HG22 ' O ' ' A' ' 17' ' ' ILE . 40.3 mm -147.12 68.35 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-O 121.657 0.741 . . . . 0.0 110.037 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.15 -35.75 67.51 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.921 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -63.46 174.89 1.14 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -109.3 -30.51 7.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.41 -51.88 66.89 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.487 ' OE1' HG23 ' A' ' 17' ' ' ILE . 12.6 mt-10 -50.88 -34.8 29.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.39 0.614 . . . . 0.0 109.42 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -72.4 -33.67 67.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.944 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.26 -43.08 95.97 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.147 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.87 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.3 t80 -64.56 -43.22 94.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.233 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.4 tp -59.09 -41.13 87.33 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.54 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -60.0 -47.92 83.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.76 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -59.09 -39.32 81.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.735 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 25' ' ' TYR . 5.1 t -63.87 -49.65 80.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.929 HD21 HD11 ' A' ' 62' ' ' ILE . 5.4 mt -62.17 -40.71 96.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.365 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -60.27 -34.53 73.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.398 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.63 ' SD ' HG11 ' A' ' 41' ' ' VAL . 4.2 mmt -66.08 -51.41 58.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.242 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.49 ' CG ' HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -53.53 -35.53 60.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.085 0.469 . . . . 0.0 110.543 179.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.21 -55.64 5.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.84 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.69 -55.24 5.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.425 ' HG1' ' C ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -82.74 -36.17 25.99 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.461 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.3 mmt 64.77 23.93 12.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.757 0.313 . . . . 0.0 111.02 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.596 ' OD2' HG23 ' A' ' 41' ' ' VAL . 29.4 t70 -100.59 114.74 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.333 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.895 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.5 t -73.01 -8.62 11.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.583 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.51 ' HB3' ' OD2' ' A' ' 38' ' ' ASP . . . -75.57 -34.26 60.67 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.072 0.463 . . . . 0.0 110.243 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.63 HG11 ' SD ' ' A' ' 32' ' ' MET . 29.0 t -73.62 -33.85 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.417 179.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.818 HD23 HG12 ' A' ' 29' ' ' VAL . 0.5 OUTLIER -69.18 -42.63 75.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.831 179.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 39' ' ' VAL . 46.7 t -58.06 -43.29 84.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.091 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.84 -56.17 15.95 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.78 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.463 ' CB ' HG22 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -63.08 -49.12 75.74 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.839 0.352 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.608 ' HG ' HG11 ' A' ' 29' ' ' VAL . 68.5 mt -50.57 -48.0 57.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.086 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.77 -49.57 72.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.075 0.464 . . . . 0.0 110.634 179.776 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.429 HD13 ' OH ' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -51.85 -39.65 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.023 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 49' ' ' VAL . 12.4 p -101.46 7.28 9.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.445 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.798 HG23 ' O ' ' A' ' 55' ' ' ARG . 77.9 mt -143.15 28.06 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.257 0.551 . . . . 0.0 111.419 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.447 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.4 p30 -89.81 14.99 10.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.641 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -130.94 150.47 76.68 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.575 0.226 . . . . 0.0 110.607 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.504 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.5 Cg_endo -52.1 -38.6 70.78 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.402 2.068 . . . . 0.0 111.447 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.32 -33.23 72.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.367 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.798 ' O ' HG23 ' A' ' 50' ' ' ILE . 11.1 mtt85 -91.75 -5.88 52.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.573 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.6 mt -60.56 -44.8 96.58 Favored Pre-proline 0 CA--C 1.53 0.206 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.68 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 90.4 Cg_exo -43.48 -28.11 1.57 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.705 2.27 . . . . 0.0 113.421 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.69 HD22 HG22 ' A' ' 13' ' ' VAL . 16.0 mt -73.85 -33.91 64.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.902 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.757 ' CE2' HG22 ' A' ' 78' ' ' THR . 0.1 OUTLIER -61.28 -48.65 80.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.734 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.409 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.1 t0 -75.22 -31.0 60.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.651 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.691 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.71 -62.89 1.53 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.738 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.929 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.81 -31.78 53.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.724 -179.585 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.505 ' HA ' HD12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -37.15 -66.69 0.27 Allowed Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 112.327 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 76.8 Cg_exo -36.6 -32.39 0.12 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.092 2.528 . . . . 0.0 113.561 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.583 HD12 ' CG1' ' A' ' 62' ' ' ILE . 19.2 mt -65.67 -51.09 62.16 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.718 0.771 . . . . 0.0 109.439 179.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.505 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.9 mt -44.26 121.87 4.08 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.373 -1.285 . . . . 0.0 111.53 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.4 ' O ' ' N ' ' A' ' 71' ' ' GLN . 76.1 Cg_exo -47.84 165.75 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.832 2.355 . . . . 0.0 112.439 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.3 tt -55.51 -56.9 14.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.785 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -44.47 97.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.43 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 23.5 m170 -63.9 -29.3 70.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.288 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.418 ' HA ' HG21 ' A' ' 66' ' ' ILE . 1.4 mt-30 -61.51 -42.08 98.27 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.172 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.89 -46.26 89.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.09 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -65.01 -33.07 75.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.213 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.704 ' O ' HG23 ' A' ' 78' ' ' THR . 59.3 t80 -62.61 -46.62 87.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.512 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.418 ' O ' ' OG1' ' A' ' 78' ' ' THR . 6.9 t0 -66.32 -32.96 74.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.752 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -66.76 -35.37 79.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.107 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.577 ' HB2' HG21 ' A' ' 43' ' ' VAL . 28.4 mt -93.09 -24.09 18.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.039 -179.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.757 HG22 ' CE2' ' A' ' 59' ' ' PHE . 2.2 p -46.51 -50.36 41.21 Favored Pre-proline 0 CA--C 1.533 0.3 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 78' ' ' THR . 22.2 Cg_endo -60.78 175.71 1.16 Allowed 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.112 1.875 . . . . 0.0 112.351 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.022 -179.929 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 29.9 t -157.87 99.43 1.69 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.846 0.355 . . . . 0.0 110.922 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.419 ' O ' HG23 ' B' ' 104' ' ' VAL . 3.9 mt -77.31 -35.55 54.84 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.852 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 13.2 tp -54.45 -52.8 60.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.854 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 45.5 tttm -57.45 -31.52 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.835 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.98 -36.79 80.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.877 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.99 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.4 t -71.04 -37.19 66.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.086 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.475 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.8 OUTLIER -65.0 -45.57 85.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.006 0.431 . . . . 0.0 110.291 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -68.92 -34.63 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -60.88 -41.08 95.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -46.92 62.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.635 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 50.2 mt -51.18 -38.24 51.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.646 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 11.4 mtt-85 -76.91 -37.27 55.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.247 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.516 HD22 ' NH2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -62.94 -16.83 60.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.104 178.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -86.86 -48.49 8.15 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.815 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.861 179.996 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.744 0.307 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.403 ' HB3' HD21 ' B' ' 100' ' ' LEU . 1.4 t70 59.88 31.51 20.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.907 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.67 -32.05 7.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.991 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.07 -40.3 89.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.947 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.7 t -60.45 -35.02 60.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.003 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.049 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.27 -50.95 42.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.182 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -65.64 -26.77 67.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -71.22 -48.98 48.11 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.688 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -70.04 -43.02 72.13 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.478 ' NE ' HD13 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -56.87 -44.11 81.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.716 178.487 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 11.5 m170 -58.49 -42.68 88.13 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.2 -35.43 75.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.29 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.68 HG13 HD22 ' A' ' 58' ' ' LEU . 43.3 t -62.22 -49.03 85.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.616 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.63 -37.74 73.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.198 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -68.95 -30.11 68.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.456 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.404 ' O ' HD13 ' A' ' 17' ' ' ILE . 5.2 mt -105.35 10.18 33.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.611 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.74 HG23 ' HB2' ' A' ' 22' ' ' GLU . 37.3 mm -146.26 67.96 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.861 0 CA-C-O 121.679 0.752 . . . . 0.0 110.151 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -79.12 -26.18 42.9 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.023 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.2 OUTLIER -49.2 -25.14 2.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.551 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 19' ' ' ASN . 5.8 t0 82.76 -53.14 0.19 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.097 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.57 -50.06 68.89 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.74 ' HB2' HG23 ' A' ' 17' ' ' ILE . 21.9 mt-10 -50.86 -34.59 28.67 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.456 ' HD3' ' CE1' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -69.23 -35.7 76.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.953 178.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.423 ' HA ' ' CD2' ' A' ' 27' ' ' TYR . 1.0 OUTLIER -62.23 -47.37 84.71 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.014 0.435 . . . . 0.0 110.187 179.467 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.906 ' O ' HG23 ' A' ' 29' ' ' VAL . 3.6 t80 -61.41 -39.33 90.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.328 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.636 HD22 HG11 ' A' ' 13' ' ' VAL . 0.2 OUTLIER -60.3 -40.99 92.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.497 179.583 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.423 ' CD2' ' HA ' ' A' ' 24' ' ' ASP . 11.6 m-85 -60.87 -46.82 89.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.408 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.43 -37.03 82.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.766 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 1.062 HG12 HD13 ' A' ' 42' ' ' LEU . 21.8 t -63.29 -44.64 99.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.807 HD21 HD11 ' A' ' 62' ' ' ILE . 7.0 mt -64.77 -46.41 82.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.509 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -32.33 72.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.46 ' HG2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -68.23 -45.72 72.48 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.454 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.652 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.3 t80 -59.47 -38.37 80.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.963 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -74.52 -44.9 49.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.826 0.346 . . . . 0.0 111.544 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -55.09 5.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.263 -0.426 . . . . 0.0 112.059 -179.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 p -74.71 -40.24 61.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.434 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.2 mtp 69.96 26.04 4.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.89 0.376 . . . . 0.0 110.7 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.46 124.66 53.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.645 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.889 ' O ' HG23 ' A' ' 43' ' ' VAL . 29.6 t -77.33 -10.36 13.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.207 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.72 -35.41 44.89 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.964 0.411 . . . . 0.0 110.61 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.46 HG11 ' HG2' ' A' ' 32' ' ' MET . 32.8 t -71.11 -34.3 54.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.236 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.062 HD13 HG12 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -70.0 -47.99 59.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.002 179.78 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 39' ' ' VAL . 46.9 t -57.44 -40.41 74.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.788 0.328 . . . . 0.0 111.039 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.93 -56.25 17.42 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.698 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.503 ' HB3' HG22 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.43 -48.61 77.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.838 0.351 . . . . 0.0 111.13 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.56 -46.93 57.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.147 -179.707 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.3 -52.33 64.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.792 179.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.92 -38.6 36.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.958 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.626 HG21 HD12 ' A' ' 26' ' ' LEU . 14.7 p -101.2 4.6 10.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.594 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.901 HG23 ' O ' ' A' ' 55' ' ' ARG . 58.2 mt -138.46 27.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 121.267 0.555 . . . . 0.0 111.161 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.435 ' N ' ' O ' ' A' ' 47' ' ' LYS . 34.3 m-20 -85.49 12.81 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.748 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.75 142.82 43.23 Favored Pre-proline 0 C--N 1.334 -0.071 0 O-C-N 122.3 -0.25 . . . . 0.0 110.674 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.441 ' HA ' HD12 ' A' ' 56' ' ' LEU . 88.5 Cg_exo -46.27 -38.87 20.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.288 1.992 . . . . 0.0 111.788 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -33.62 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.588 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.901 ' O ' HG23 ' A' ' 50' ' ' ILE . 40.8 mtt180 -90.75 -11.43 39.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.727 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.497 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -54.31 -45.35 99.28 Favored Pre-proline 0 CA--C 1.531 0.248 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.497 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 88.0 Cg_exo -45.87 -24.76 2.28 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.853 2.369 . . . . 0.0 113.667 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.68 HD22 HG13 ' A' ' 13' ' ' VAL . 9.3 mt -72.92 -35.83 67.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.698 0.285 . . . . 0.0 110.919 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.665 ' HE2' HG22 ' A' ' 78' ' ' THR . 0.3 OUTLIER -58.01 -50.79 72.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.751 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.422 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 2.8 t0 -75.38 -31.26 60.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.809 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.469 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.9 -56.25 23.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.849 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.807 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -67.17 -32.54 58.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 111.559 -179.548 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.5 mtp180 -37.37 -63.72 0.47 Allowed Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.473 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.439 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 74.9 Cg_exo -36.9 -32.64 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 123.127 2.552 . . . . 0.0 113.617 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.532 HD11 ' CE2' ' A' ' 9' ' ' PHE . 14.1 mt -65.53 -50.75 64.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.624 0.726 . . . . 0.0 109.79 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.465 HG13 ' CE2' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -46.62 133.07 8.14 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.242 179.754 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -49.6 165.6 0.26 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.64 2.226 . . . . 0.0 112.284 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -57.87 10.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.855 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -50.02 75.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.039 0.447 . . . . 0.0 110.303 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.441 ' CB ' HG23 ' A' ' 66' ' ' ILE . 53.0 m170 -60.7 -27.59 68.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.374 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -65.35 -44.21 88.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.9 179.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.456 HG12 ' NE2' ' A' ' 76' ' ' GLN . 19.9 t -61.45 -43.54 96.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.326 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -66.51 -47.06 74.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.383 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.911 ' O ' HG23 ' A' ' 78' ' ' THR . 35.7 t80 -60.44 -37.44 80.92 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.443 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.496 ' O ' ' HD3' ' A' ' 79' ' ' PRO . 0.6 OUTLIER -65.76 -44.06 87.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.587 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.456 ' NE2' HG12 ' A' ' 72' ' ' VAL . 52.9 mt-30 -67.0 -24.61 66.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.551 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 mt -90.52 -26.0 19.98 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.911 HG23 ' O ' ' A' ' 74' ' ' TYR . 75.4 p -50.82 -37.65 35.18 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 78' ' ' THR . 1.9 Cg_endo -82.31 -175.16 2.38 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.687 2.258 . . . . 0.0 112.316 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 16.9 ptt-85 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.732 179.908 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 N-CA-C 112.551 -0.219 . . . . 0.0 112.551 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 74.3 p -147.7 113.01 5.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.824 0.345 . . . . 0.0 110.839 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.424 ' HB3' HD22 ' A' ' 65' ' ' LEU . 49.6 mt -114.2 -31.62 6.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.032 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.505 HD23 ' H ' ' B' ' 101' ' ' LEU . 0.4 OUTLIER -54.03 -35.18 61.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.128 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.535 ' HA ' HD21 ' B' ' 105' ' ' LEU . 0.0 OUTLIER -68.6 -33.19 73.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -69.95 -38.23 76.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.049 HG22 ' HB1' ' A' ' 6' ' ' ALA . 39.0 t -71.01 -51.0 38.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.371 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.566 HD12 ' N ' ' B' ' 106' ' ' GLU . 3.8 pp -61.57 -33.48 73.94 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.573 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . 0.566 ' N ' HD12 ' B' ' 105' ' ' LEU . 6.6 tt0 -73.79 -38.77 64.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 0.0 110.257 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -67.23 -29.18 68.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.591 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.477 ' CD2' ' HG3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.81 -56.57 4.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.013 0.435 . . . . 0.0 110.99 -179.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.841 HD12 ' N ' ' B' ' 110' ' ' ARG . 4.0 pp -52.91 -39.46 62.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.67 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . 0.841 ' N ' HD12 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -77.03 -34.72 57.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.579 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.478 HD13 ' NE ' ' A' ' 10' ' ' ARG . 5.9 mt -64.89 -17.11 64.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.177 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' B' ' 108' ' ' TYR . 28.9 mmmt -99.18 -40.56 7.91 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.679 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.888 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.433 0 CA-C-O 120.756 0.312 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.2 p-10 -141.61 -46.42 0.37 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.007 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.78 -34.83 18.17 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.948 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.95 -33.68 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.829 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -63.43 -35.92 74.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.018 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -70.22 -50.89 35.27 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.964 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -26.81 68.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.155 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -70.97 -48.98 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.357 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.77 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.04 -43.59 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.084 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.745 ' HD2' HG12 ' B' ' 104' ' ' VAL . 2.5 tpm_? -57.1 -44.94 83.7 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.712 178.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -57.83 -40.04 79.1 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.792 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.7 mtpt -62.82 -36.8 84.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.029 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.902 HG22 HD22 ' A' ' 58' ' ' LEU . 46.5 t -58.59 -48.99 84.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.285 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -57.58 -42.25 82.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.081 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -69.1 -34.62 75.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.523 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.433 ' O ' HD13 ' A' ' 17' ' ' ILE . 78.3 mt -95.12 7.34 46.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.595 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 17' ' ' ILE . 40.0 mm -148.27 68.69 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.73 0.776 . . . . 0.0 110.129 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -57.16 -36.13 70.38 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.97 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -64.55 169.18 5.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.695 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -102.54 -31.46 10.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.95 67.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.933 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.623 ' O ' HD12 ' A' ' 26' ' ' LEU . 22.5 mt-10 -50.77 -34.69 28.29 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 27.7 mttt -72.71 -35.19 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.939 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -62.86 -41.11 99.24 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.132 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.804 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -65.92 -45.75 80.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.298 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.623 HD12 ' O ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -60.36 -39.56 87.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.703 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.0 m-85 -61.82 -44.06 97.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.701 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -65.56 -40.98 93.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.648 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.804 HG23 ' O ' ' A' ' 25' ' ' TYR . 46.4 t -60.82 -53.25 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.063 0.459 . . . . 0.0 110.982 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.007 HD21 HD11 ' A' ' 62' ' ' ILE . 4.0 mt -59.98 -36.19 76.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.657 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.43 ' NH2' HD11 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -66.77 -43.14 84.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.569 179.796 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -45.06 94.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.046 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.675 ' CE1' HG22 ' A' ' 39' ' ' VAL . 6.6 t80 -57.65 -48.17 80.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.781 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.71 ' HD2' HD23 ' B' ' 101' ' ' LEU . 1.8 t-80 -74.99 -33.66 61.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.873 0.368 . . . . 0.0 111.664 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -77.44 -54.98 5.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.7 p -93.98 -6.0 46.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.475 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.5 mmt 58.87 23.5 11.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.708 0.29 . . . . 0.0 110.96 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.419 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.5 t0 -98.22 116.72 31.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.915 0.388 . . . . 0.0 110.912 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.845 ' O ' HG23 ' A' ' 43' ' ' VAL . 27.8 t -82.52 -20.7 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.27 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.64 -28.1 55.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.804 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 38' ' ' ASP . 48.0 t -73.46 -43.77 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.782 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.5 pp -68.53 -39.21 81.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.753 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.845 HG23 ' O ' ' A' ' 39' ' ' VAL . 84.9 t -60.65 -40.71 85.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.853 0.358 . . . . 0.0 110.389 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.51 -59.13 9.23 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.26 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.474 ' CB ' HG22 ' A' ' 29' ' ' VAL . 12.4 m-20 -60.1 -44.2 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.984 0.421 . . . . 0.0 110.771 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.773 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.7 mt -51.3 -44.13 61.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -56.73 -48.31 78.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.105 0.479 . . . . 0.0 110.627 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 mt -54.17 -37.53 64.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.824 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 49' ' ' VAL . 11.9 p -101.04 5.13 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.428 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.879 HG23 ' O ' ' A' ' 55' ' ' ARG . 65.7 mt -142.33 29.08 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-O 121.301 0.572 . . . . 0.0 110.72 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.7 p-10 -88.07 15.2 7.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.945 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.2 pt-20 -131.69 149.12 72.54 Favored Pre-proline 0 C--N 1.334 -0.098 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.765 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.603 ' HA ' HD12 ' A' ' 56' ' ' LEU . 7.2 Cg_endo -49.51 -38.51 44.47 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.697 2.265 . . . . 0.0 111.812 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.2 t -69.12 -33.93 74.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.609 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.879 ' O ' HG23 ' A' ' 50' ' ' ILE . 97.9 mtt180 -94.5 -5.28 46.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.685 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.603 HD12 ' HA ' ' A' ' 53' ' ' PRO . 12.2 mt -59.44 -45.24 98.91 Favored Pre-proline 0 CA--C 1.532 0.284 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 81.4 Cg_exo -42.94 -29.03 1.38 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.772 2.315 . . . . 0.0 113.475 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.902 HD22 HG22 ' A' ' 13' ' ' VAL . 14.4 mt -73.94 -32.29 63.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.741 0.305 . . . . 0.0 111.023 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.469 ' CD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -60.83 -50.02 75.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.095 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.407 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 22.5 t0 -75.21 -31.02 60.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.894 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.739 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.73 -60.26 4.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.95 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 1.007 HD11 HD21 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -59.3 -36.99 66.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.928 -179.534 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.475 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -36.32 -66.8 0.25 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.479 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.478 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 79.7 Cg_exo -36.14 -33.04 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.191 2.594 . . . . 0.0 113.342 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.657 HD11 ' CE2' ' A' ' 9' ' ' PHE . 22.7 mt -65.07 -51.93 58.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.463 0.649 . . . . 0.0 109.875 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.427 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -47.22 136.73 8.74 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.032 179.622 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.25 165.61 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.483 2.122 . . . . 0.0 112.34 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.1 tp -57.09 -57.87 10.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.955 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -51.41 69.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.106 0.479 . . . . 0.0 110.345 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.427 ' CB ' HG23 ' A' ' 66' ' ' ILE . 31.5 m170 -59.91 -28.31 67.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.325 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.32 -44.31 95.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.086 0.469 . . . . 0.0 110.155 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.32 -47.35 93.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.345 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.45 -39.38 93.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.356 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.892 ' O ' HG23 ' A' ' 78' ' ' THR . 57.6 t80 -63.51 -42.69 98.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.691 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -45.5 91.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.704 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -59.97 -39.46 85.72 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.672 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 74' ' ' TYR . 9.0 mt -70.58 -30.09 66.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.861 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.892 HG23 ' O ' ' A' ' 74' ' ' TYR . 16.0 p -87.89 149.51 45.87 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.784 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -73.82 103.53 1.67 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.466 2.111 . . . . 0.0 112.346 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.922 179.983 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.554 -0.219 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 69.5 p -147.56 98.7 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.842 0.353 . . . . 0.0 110.856 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.656 ' O ' HG23 ' B' ' 104' ' ' VAL . 6.0 mt -82.68 -55.03 4.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.952 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.812 HD11 HD23 ' A' ' 30' ' ' LEU . 13.9 tp -55.1 -52.86 61.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.093 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.6 -37.57 68.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.92 -36.54 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.719 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.018 HG22 ' HB1' ' A' ' 6' ' ' ALA . 2.1 t -71.09 -34.09 53.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.078 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' B' ' 101' ' ' LEU . 0.9 OUTLIER -70.87 -45.72 63.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.973 0.416 . . . . 0.0 110.365 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.0 -39.74 87.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.903 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -59.65 -50.41 73.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.753 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.436 ' CD1' ' HG2' ' A' ' 10' ' ' ARG . 1.4 t80 -71.8 -43.88 64.9 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.811 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.43 HD11 ' NH2' ' A' ' 31' ' ' ARG . 13.2 mt -51.11 -40.78 59.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.662 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -76.89 -35.09 57.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.058 179.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -16.47 61.2 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.389 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 3.9 mmmt -81.44 -51.05 8.72 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.825 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.4 pttt . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.374 179.915 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.786 0.327 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -132.54 -179.95 5.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.89 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.89 -33.14 74.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.915 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -65.58 -36.81 84.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.753 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.2 -35.13 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.912 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.006 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.63 -51.15 53.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.271 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.427 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -64.41 -26.95 68.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.245 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.8 -49.08 50.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.588 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.553 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -68.83 -43.29 75.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 179.1 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HG3' ' CG1' ' B' ' 104' ' ' VAL . 0.7 OUTLIER -61.96 -40.23 94.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.881 178.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.427 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 8.2 m170 -56.99 -41.37 78.28 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -60.96 -36.11 78.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.795 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.627 HG13 HD22 ' A' ' 58' ' ' LEU . 50.1 t -58.82 -48.7 85.38 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.105 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.17 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.7 -39.22 76.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.119 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -68.78 -31.15 69.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.465 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.3 mt -102.29 8.94 40.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.44 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 17' ' ' ILE . 31.3 mm -149.97 69.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 CA-C-O 121.677 0.751 . . . . 0.0 110.025 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -58.96 -33.84 71.11 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.899 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -63.46 160.8 15.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.801 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -97.64 -30.76 12.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.978 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.15 -52.95 61.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.007 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -50.95 -34.78 30.22 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.2 mttt -72.82 -34.3 66.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.766 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -61.77 -43.03 99.65 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -65.55 -45.54 83.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.289 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.7 tt -60.81 -40.81 94.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.455 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.419 ' OH ' ' CE2' ' B' ' 108' ' ' TYR . 14.1 m-85 -59.26 -43.42 92.46 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -69.54 -37.34 77.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.813 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 25' ' ' TYR . 40.7 t -62.36 -52.33 61.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.876 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.017 HD21 HD11 ' A' ' 62' ' ' ILE . 41.2 mt -60.9 -41.12 95.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.667 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -40.22 87.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.268 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -45.62 87.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.971 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.561 ' CG ' HD22 ' A' ' 42' ' ' LEU . 4.9 t80 -55.58 -44.67 77.1 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.941 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -74.87 -34.42 62.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.556 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.47 -55.06 5.7 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.0 p -88.07 -14.62 38.43 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.447 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 6.8 mmt 61.37 23.6 13.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.739 0.304 . . . . 0.0 110.626 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -98.48 116.72 31.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.744 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.762 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.4 t -81.27 -20.77 10.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.281 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.09 -29.27 48.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.339 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.2 t -73.42 -42.88 56.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.79 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.749 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.1 pp -70.2 -39.73 75.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.744 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.762 HG23 ' O ' ' A' ' 39' ' ' VAL . 81.6 t -65.01 -37.36 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.938 0.399 . . . . 0.0 110.388 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.34 -56.68 18.59 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.137 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -64.72 -44.69 89.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.857 0.36 . . . . 0.0 110.774 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.874 ' HG ' HG11 ' A' ' 29' ' ' VAL . 13.7 mt -50.97 -41.07 59.15 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.688 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.48 -46.62 89.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.398 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.68 -34.49 65.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.563 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 49' ' ' VAL . 9.4 p -100.92 0.3 10.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.3 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.902 HG23 ' O ' ' A' ' 55' ' ' ARG . 50.8 mt -138.5 29.31 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.334 0.587 . . . . 0.0 110.939 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.483 ' N ' ' O ' ' A' ' 47' ' ' LYS . 20.7 p30 -87.53 16.77 5.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.787 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.407 ' O ' ' N ' ' A' ' 56' ' ' LEU . 4.7 mm-40 -127.35 143.57 47.7 Favored Pre-proline 0 C--N 1.334 -0.091 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.443 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.427 ' HA ' HD12 ' A' ' 56' ' ' LEU . 5.6 Cg_endo -47.83 -38.47 30.37 Favored 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.452 2.101 . . . . 0.0 111.518 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.33 -33.8 73.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.713 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.902 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.8 mtt180 -92.04 -10.32 39.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.885 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.493 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.9 mt -55.62 -44.7 99.79 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.733 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.3 Cg_exo -44.31 -26.77 1.73 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.661 2.24 . . . . 0.0 113.474 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.699 HD12 HG12 ' A' ' 50' ' ' ILE . 3.7 mt -73.69 -32.0 63.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.842 0.353 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.504 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -67.54 -40.78 85.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.81 179.864 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 18.2 t70 -75.37 -31.0 60.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.811 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.63 -56.84 6.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.864 -179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 1.017 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -61.27 -38.16 79.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.86 -179.239 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.444 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -39.69 -65.14 0.45 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.258 -179.002 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 70.6 Cg_exo -35.59 -32.91 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.261 2.641 . . . . 0.0 113.483 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' A' ' 9' ' ' PHE . 12.6 mt -65.07 -53.72 41.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.307 0.575 . . . . 0.0 109.822 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.557 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.5 mp -42.26 128.15 2.8 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.306 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.79 165.69 1.09 Allowed 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.791 2.328 . . . . 0.0 112.347 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 tp -52.47 -53.6 43.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.031 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.539 ' O ' HG12 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -57.51 -54.65 44.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.682 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.557 ' CB ' HG23 ' A' ' 66' ' ' ILE . 27.2 m170 -63.11 -20.44 65.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.555 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -53.91 32.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.967 0.413 . . . . 0.0 110.244 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 69' ' ' LYS . 6.1 p -61.91 -37.17 77.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.161 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.68 -38.12 73.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.065 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 78' ' ' THR . 9.6 t80 -60.35 -49.08 78.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.468 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -62.91 -37.28 86.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.602 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -42.77 85.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.703 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.5 mt -72.75 -30.72 64.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.975 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.898 HG23 ' O ' ' A' ' 74' ' ' TYR . 23.0 p -71.07 126.83 92.06 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.862 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -55.0 140.06 79.8 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.438 2.092 . . . . 0.0 112.103 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.884 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . 0.469 ' HA2' HD21 ' B' ' 101' ' ' LEU . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.534 -0.227 . . . . 0.0 112.534 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.74 -41.16 2.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.928 0.394 . . . . 0.0 111.037 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.45 ' HB3' HD22 ' A' ' 65' ' ' LEU . 6.9 mt -115.45 -33.17 5.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.158 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.47 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -54.21 -40.55 67.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.993 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.553 ' HA ' HD21 ' B' ' 105' ' ' LEU . 0.6 OUTLIER -66.84 -31.99 72.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.86 -34.9 74.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.053 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.006 HG22 ' HB1' ' A' ' 6' ' ' ALA . 25.2 t -70.85 -55.19 14.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.342 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.587 HD12 ' N ' ' B' ' 106' ' ' GLU . 2.8 pp -58.6 -40.98 84.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.803 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . 0.587 ' N ' HD12 ' B' ' 105' ' ' LEU . 10.5 tt0 -73.7 -33.42 64.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.804 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.57 -48.35 79.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.039 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' B' ' 112' ' ' LYS . 0.3 OUTLIER -71.38 -48.97 46.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.864 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 10.0 mt -50.93 -38.66 51.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.499 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.88 -34.06 57.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.117 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 mp -66.37 -15.37 63.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.301 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' B' ' 108' ' ' TYR . 6.0 mmmm -72.09 -73.86 0.18 Allowed 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.775 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.921 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 ttm . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.81 0.338 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 3' ' ' ARG . 1.2 t0 -178.37 139.26 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.783 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 2' ' ' ASP . 10.3 mpt_? 69.93 -54.2 0.61 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.652 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.6 tttp -58.69 -33.4 70.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.9 0.381 . . . . 0.0 110.533 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 51.6 t -59.89 -38.66 77.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.83 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.804 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.71 -51.04 54.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.27 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.437 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 0.0 OUTLIER -67.04 -26.88 66.97 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.108 179.392 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -72.64 -48.84 36.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.388 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.924 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -68.44 -42.86 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' CD ' HG12 ' B' ' 104' ' ' VAL . 2.1 tpt180 -58.26 -46.12 86.57 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.095 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.7 t-160 -56.54 -42.05 77.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -60.75 -35.92 77.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.292 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.673 HG22 HD22 ' A' ' 58' ' ' LEU . 60.5 t -60.67 -49.84 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.601 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -57.75 -39.34 77.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.501 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -69.12 -30.12 68.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.735 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.452 HD13 ' HG2' ' A' ' 57' ' ' PRO . 82.4 mt -96.43 -0.22 49.5 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.621 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.991 HD11 HD11 ' A' ' 58' ' ' LEU . 91.4 mt -143.95 69.02 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 CA-C-O 122.122 0.963 . . . . 0.0 110.374 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -76.07 -2.81 32.63 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.88 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -71.66 -23.54 61.69 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 t0 78.55 -55.83 0.47 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.19 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -51.91 57.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.857 0.36 . . . . 0.0 111.245 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.49 ' HB2' HG23 ' A' ' 17' ' ' ILE . 22.6 mt-10 -50.88 -34.75 29.52 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -71.02 -34.46 71.32 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.89 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -45.09 96.06 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.114 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.886 ' O ' HG23 ' A' ' 29' ' ' VAL . 10.6 t80 -64.57 -41.39 96.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.149 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.608 HD23 HG11 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -60.69 -36.57 79.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.533 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -64.6 -47.38 78.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.612 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.4 -37.22 86.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.594 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 25' ' ' TYR . 40.8 t -69.34 -36.39 71.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.608 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.974 HD21 HD11 ' A' ' 62' ' ' ILE . 14.0 mt -68.53 -43.95 75.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.54 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -36.75 84.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.382 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.76 ' CE ' HG21 ' A' ' 36' ' ' THR . 0.0 OUTLIER -63.97 -48.23 77.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.202 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.715 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.1 t80 -55.51 -43.06 75.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.992 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.561 ' HD2' HD23 ' B' ' 101' ' ' LEU . 34.0 t-80 -74.78 -38.45 62.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.782 -179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -55.08 5.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.76 HG21 ' CE ' ' A' ' 32' ' ' MET . 63.2 p -82.9 -13.81 55.38 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -178.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.432 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 20.5 mmt 60.45 21.18 10.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.768 0.318 . . . . 0.0 110.929 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.8 OUTLIER -94.52 113.11 24.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.857 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.8 t -82.12 -23.32 9.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.225 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.82 -28.8 58.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.986 0.422 . . . . 0.0 110.915 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.611 HG23 ' HB3' ' A' ' 38' ' ' ASP . 53.8 t -73.42 -43.93 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.841 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.715 HD22 ' CG ' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -69.23 -37.04 77.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.678 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 39' ' ' VAL . 71.7 t -62.09 -46.38 96.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.955 0.407 . . . . 0.0 110.144 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -58.42 -56.63 24.17 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.995 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.602 ' HA ' HD12 ' A' ' 48' ' ' LEU . 64.7 m-20 -60.6 -36.94 79.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 110.447 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.851 HD22 ' CD1' ' A' ' 50' ' ' ILE . 10.4 mt -52.45 -46.21 66.35 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.523 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.8 mptt -55.42 -46.38 76.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.543 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.602 HD12 ' HA ' ' A' ' 45' ' ' ASP . 5.1 mt -54.41 -39.47 67.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.641 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.608 HG11 HD23 ' A' ' 26' ' ' LEU . 14.4 p -101.13 8.61 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.272 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.851 ' CD1' HD22 ' A' ' 46' ' ' LEU . 88.3 mt -144.79 28.68 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 121.305 0.574 . . . . 0.0 110.666 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' ' O ' ' A' ' 47' ' ' LYS . 21.9 p-10 -86.21 10.35 14.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.219 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -133.4 155.97 80.21 Favored Pre-proline 0 C--N 1.334 -0.084 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.249 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.559 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.4 Cg_endo -52.29 -38.84 73.21 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.824 2.349 . . . . 0.0 112.086 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.75 -34.18 75.15 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.461 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.844 ' O ' HG23 ' A' ' 50' ' ' ILE . 87.1 mtt180 -94.49 -1.21 53.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.743 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 53' ' ' PRO . 11.9 mt -64.73 -47.41 75.45 Favored Pre-proline 0 CA--C 1.53 0.203 0 CA-C-O 120.605 0.24 . . . . 0.0 111.644 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.52 -26.81 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.732 2.288 . . . . 0.0 113.605 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.991 HD11 HD11 ' A' ' 17' ' ' ILE . 20.8 mt -69.71 -34.84 74.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.725 0.298 . . . . 0.0 111.242 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.501 ' CD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -56.52 -48.38 77.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.01 0.433 . . . . 0.0 110.887 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.474 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 6.0 p-10 -75.28 -31.01 60.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.867 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.924 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.69 -56.96 14.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.996 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.974 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -67.49 -37.64 79.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.458 -178.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.608 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 11.6 ttm-85 -37.37 -59.88 0.96 Allowed Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 90.8 Cg_exo -38.24 -37.14 0.6 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.86 2.373 . . . . 0.0 113.094 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.667 HD13 HD12 ' B' ' 101' ' ' LEU . 12.3 mt -65.2 -54.11 34.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.369 0.604 . . . . 0.0 110.047 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.53 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -44.31 129.02 4.67 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.148 179.552 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.404 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 78.4 Cg_exo -50.62 165.27 0.43 Allowed 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.63 2.22 . . . . 0.0 112.424 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.786 ' O ' HG23 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -56.16 -49.21 74.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.296 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -46.62 81.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.137 0.494 . . . . 0.0 110.418 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.561 ' CG ' HG21 ' A' ' 39' ' ' VAL . 29.2 m170 -64.95 -30.2 71.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.85 -32.28 69.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 0.0 110.298 179.547 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 68' ' ' LEU . 29.4 t -67.9 -46.2 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.061 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -69.18 -38.49 78.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.227 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.526 ' O ' HG23 ' A' ' 78' ' ' THR . 11.3 t80 -60.91 -42.68 98.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.335 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.41 ' O ' ' HD3' ' A' ' 79' ' ' PRO . 3.5 t0 -62.27 -48.72 78.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.522 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -66.63 -18.85 65.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.34 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.6 mt -86.58 -27.76 23.7 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.548 ' OG1' ' HD3' ' A' ' 79' ' ' PRO . 1.4 p -57.13 -46.03 99.88 Favored Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.548 ' HD3' ' OG1' ' A' ' 78' ' ' THR . 63.9 Cg_endo -72.89 -43.96 0.71 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.043 1.829 . . . . 0.0 112.2 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.928 -179.926 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 12.7 p 59.08 -172.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.299 . . . . 0.0 110.83 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.451 ' O ' HG23 ' B' ' 104' ' ' VAL . 65.6 mt 69.69 -58.14 0.53 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.466 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.667 HD12 HD13 ' A' ' 65' ' ' LEU . 8.6 tp -51.63 -52.64 46.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.827 0.346 . . . . 0.0 110.984 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -31.5 65.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.674 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -69.86 -32.58 71.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.804 HG22 ' HB1' ' A' ' 6' ' ' ALA . 1.6 t -71.04 -43.27 76.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.668 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.523 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.7 OUTLIER -65.67 -45.59 82.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.258 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.52 -33.64 73.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.63 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.79 -50.45 73.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.024 0.44 . . . . 0.0 110.899 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -74.43 -48.89 24.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.764 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' B' ' 109' ' ' LEU . 13.8 mt -51.33 -41.39 60.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.704 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 73.3 mtt180 -76.89 -33.87 57.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.283 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.502 HD23 ' C ' ' B' ' 111' ' ' LEU . 0.4 OUTLIER -65.35 -16.03 63.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.053 179.023 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 3.9 mmtp -75.16 -76.94 0.13 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.917 0.389 . . . . 0.0 110.824 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.2 mtmt . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.896 -179.969 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.818 0.342 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.48 152.64 18.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 80.38 -41.32 0.2 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.645 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -59.02 -33.38 70.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.754 0.311 . . . . 0.0 110.763 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.8 t -56.95 -38.61 60.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.012 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.976 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.33 -50.93 58.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.071 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.415 ' HD2' ' HB3' ' B' ' 107' ' ' ASP . 0.0 OUTLIER -63.75 -26.92 68.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.238 179.432 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -49.15 51.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.626 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.669 ' HE2' HG21 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.18 -43.19 74.72 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.514 ' NH1' HD13 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -56.88 -45.2 82.7 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.907 178.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 14.6 t-160 -57.69 -41.82 82.42 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.117 0.484 . . . . 0.0 109.852 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -60.14 -35.98 76.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.001 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.66 HG13 ' CD2' ' A' ' 58' ' ' LEU . 48.0 t -61.21 -47.7 92.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.32 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -57.6 -39.03 75.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.149 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -69.0 -34.66 75.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.429 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 17' ' ' ILE . 69.5 mt -95.88 6.28 49.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.508 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.609 HG22 ' O ' ' A' ' 17' ' ' ILE . 39.2 mm -148.08 69.03 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-O 121.708 0.766 . . . . 0.0 110.081 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -56.56 -33.51 66.21 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.016 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.82 164.26 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.771 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -98.82 -32.7 11.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.942 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.93 63.16 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.953 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' HG23 ' A' ' 17' ' ' ILE . 27.0 mt-10 -50.87 -34.69 29.16 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 19.3 mttt -73.29 -34.77 65.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.947 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.73 -40.57 97.07 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.14 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.897 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -67.17 -43.65 81.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.403 179.381 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.468 HD22 HG11 ' A' ' 13' ' ' VAL . 28.2 tp -61.5 -38.11 86.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.647 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 20.5 m-85 -63.22 -46.3 87.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.664 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -38.07 88.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.626 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 25' ' ' TYR . 34.8 t -62.24 -47.09 94.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.878 HD21 HD11 ' A' ' 62' ' ' ILE . 17.0 mt -64.39 -44.79 90.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.496 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -65.4 -35.09 79.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.415 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.404 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -68.34 -44.71 74.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.442 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.976 ' CD2' HD13 ' B' ' 101' ' ' LEU . 8.9 t80 -61.08 -36.07 78.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.115 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -74.43 -41.0 61.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.581 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.597 ' HG3' HG23 ' A' ' 36' ' ' THR . 15.7 pt20 -77.43 -52.51 9.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.987 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.597 HG23 ' HG3' ' A' ' 35' ' ' GLN . 17.7 p -79.38 -21.93 45.04 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.8 mmt 60.66 22.39 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.672 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.456 ' HB3' HG23 ' A' ' 41' ' ' VAL . 8.2 m-20 -104.13 119.77 39.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.776 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.76 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.9 t -79.14 -18.29 13.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.237 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.16 -29.63 48.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.456 HG23 ' HB3' ' A' ' 38' ' ' ASP . 46.6 t -73.47 -44.41 54.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.662 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.759 HD12 HD12 ' A' ' 46' ' ' LEU . 1.2 pp -68.98 -38.31 79.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.767 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 39' ' ' VAL . 70.8 t -66.82 -37.32 79.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.917 0.389 . . . . 0.0 110.422 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.4 -57.96 14.47 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.68 -0.772 . . . . 0.0 111.894 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.69 -41.7 99.25 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.945 0.403 . . . . 0.0 110.634 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.839 ' HG ' HG11 ' A' ' 29' ' ' VAL . 11.2 mt -52.19 -40.17 61.15 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.622 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -59.92 -46.61 88.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.386 179.468 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.9 mt -55.53 -36.72 67.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.485 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.631 HG13 HG13 ' A' ' 50' ' ' ILE . 14.6 p -101.13 4.53 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.394 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.916 HG23 ' O ' ' A' ' 55' ' ' ARG . 73.9 mt -142.52 29.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 121.26 0.552 . . . . 0.0 110.997 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.486 ' N ' ' O ' ' A' ' 47' ' ' LYS . 18.3 p30 -87.51 16.72 5.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.917 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.409 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 5.0 mm-40 -129.54 142.54 45.63 Favored Pre-proline 0 C--N 1.333 -0.11 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.65 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.538 ' HA ' HD12 ' A' ' 56' ' ' LEU . 85.7 Cg_exo -45.69 -39.01 17.83 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.205 1.936 . . . . 0.0 111.835 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 t -69.25 -35.14 75.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.698 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.916 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -89.96 -10.5 44.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.74 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.1 mt -53.08 -46.11 97.86 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 95.6 Cg_exo -44.17 -26.57 1.56 Allowed 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.727 2.285 . . . . 0.0 113.67 -179.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.66 ' CD2' HG13 ' A' ' 13' ' ' VAL . 26.5 mt -73.67 -30.25 62.79 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.064 -0.254 . . . . 0.0 111.114 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.532 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -69.72 -44.35 70.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.987 0.422 . . . . 0.0 110.704 179.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.31 -31.42 60.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.848 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.523 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.66 -57.32 10.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.656 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.878 HD11 HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -65.83 -31.46 53.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.514 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.466 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 2.7 ttp180 -40.04 -59.58 1.75 Allowed Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.5 Cg_endo -48.81 -26.1 9.27 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.801 2.334 . . . . 0.0 113.348 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.616 HD11 ' CE2' ' A' ' 9' ' ' PHE . 21.0 mt -65.01 -54.54 28.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.35 0.595 . . . . 0.0 109.694 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.582 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.1 mp -42.07 136.03 2.26 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.425 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.46 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 54.2 Cg_exo -52.24 165.79 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.807 2.338 . . . . 0.0 112.46 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.3 -55.96 25.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.16 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -50.24 74.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.979 0.419 . . . . 0.0 110.435 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.582 ' CB ' HG23 ' A' ' 66' ' ' ILE . 26.8 m170 -61.73 -28.24 69.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.178 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.77 -43.72 98.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.92 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 34.3 t -62.31 -45.22 99.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.96 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.04 -30.75 71.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.828 ' O ' HG23 ' A' ' 78' ' ' THR . 4.5 t80 -62.01 -50.27 72.72 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.672 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.47 -42.23 98.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.678 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -59.24 -35.09 73.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.666 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.5 mt -81.55 -33.13 31.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.821 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.828 HG23 ' O ' ' A' ' 74' ' ' TYR . 22.4 p -85.21 109.56 22.12 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.983 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.84 134.9 31.21 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.348 2.032 . . . . 0.0 112.375 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.801 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.19 83.83 2.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.933 0.397 . . . . 0.0 110.927 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.433 ' HB3' HD22 ' A' ' 65' ' ' LEU . 0.7 OUTLIER -66.32 -39.26 89.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.927 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.976 HD13 ' CD2' ' A' ' 33' ' ' TYR . 0.3 OUTLIER -56.46 -36.75 69.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.928 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.558 ' HA ' HD21 ' B' ' 105' ' ' LEU . 3.8 tttt -68.54 -32.01 71.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.819 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.96 -37.31 75.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.082 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.976 HG22 ' HB1' ' A' ' 6' ' ' ALA . 33.2 t -69.58 -54.54 19.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.518 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.57 HD12 ' N ' ' B' ' 106' ' ' GLU . 2.4 pp -57.34 -39.8 76.66 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.677 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . 0.57 ' N ' HD12 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -73.01 -34.86 66.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.342 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.415 ' HB3' ' HD2' ' A' ' 7' ' ' ARG . 1.6 m-20 -65.19 -36.76 85.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.622 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.444 ' CE2' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -69.54 -48.43 60.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.3 179.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 61.9 mt -53.04 -40.6 64.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.697 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . 0.406 ' CZ ' ' HB2' ' B' ' 110' ' ' ARG . 4.8 ptm85 -76.83 -39.17 52.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.007 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.514 HD13 ' NH1' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -72.18 -6.83 45.52 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.762 179.355 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -85.94 -78.6 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.854 0.359 . . . . 0.0 110.93 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 10.7 mmtp . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.942 179.972 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 mtm . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 120.911 0.386 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.67 -30.15 19.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.95 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -31.07 70.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -59.61 -39.22 83.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.4 t -61.13 -35.06 63.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.882 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.968 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.02 -51.18 41.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.236 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.466 ' HA ' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -67.64 -26.87 66.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.25 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -73.18 -46.06 52.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.363 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.953 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.92 -44.74 65.56 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -63.89 -35.99 82.48 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 179.259 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.465 ' N ' ' HG3' ' A' ' 10' ' ' ARG . 20.5 t-160 -62.32 -42.66 99.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -61.1 -35.91 78.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.82 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.89 HG22 HD23 ' A' ' 58' ' ' LEU . 64.0 t -62.84 -44.85 99.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.306 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.48 -42.21 82.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.958 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -69.15 -37.17 78.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.267 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.3 mt -89.9 6.06 43.61 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.417 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.662 HG22 ' O ' ' A' ' 17' ' ' ILE . 37.4 mm -145.91 67.98 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.819 0 CA-C-O 121.743 0.782 . . . . 0.0 110.208 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.41 -31.26 67.55 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.911 -1.041 . . . . 0.0 110.917 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -73.32 122.27 21.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -62.88 -27.55 69.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.106 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.34 -52.02 63.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.899 0.38 . . . . 0.0 111.079 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.544 ' HB2' HG23 ' A' ' 17' ' ' ILE . 28.5 mt-10 -50.8 -34.59 28.14 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -71.72 -34.7 69.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.815 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.63 97.55 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.13 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.876 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -65.4 -44.71 86.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.333 179.326 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.44 -41.75 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.539 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -59.62 -43.25 93.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.523 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.65 -35.99 82.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.459 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.946 HG12 HD23 ' A' ' 42' ' ' LEU . 24.4 t -65.6 -44.98 93.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.849 HD21 HD11 ' A' ' 62' ' ' ILE . 19.2 mt -63.85 -44.4 93.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.489 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 35.6 mtp180 -59.73 -34.06 72.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.475 ' HG2' HG11 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -65.21 -52.12 56.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.495 179.5 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' A' ' 37' ' ' MET . 6.3 t80 -55.98 -34.36 65.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.123 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -74.84 -43.95 51.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.805 0.336 . . . . 0.0 111.109 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.74 -54.91 5.8 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 p -84.42 -33.08 23.79 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.546 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.2 mmt 63.77 39.28 8.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.987 0.422 . . . . 0.0 110.665 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -113.71 125.21 53.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.73 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.858 ' O ' HG23 ' A' ' 43' ' ' VAL . 17.2 t -75.76 -14.0 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.988 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -78.71 -38.94 37.8 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.996 0.427 . . . . 0.0 110.215 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.475 HG11 ' HG2' ' A' ' 32' ' ' MET . 37.8 t -69.41 -34.04 60.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.88 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.961 HD22 HD11 ' A' ' 46' ' ' LEU . 1.7 mt -66.55 -50.71 62.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.549 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.858 HG23 ' O ' ' A' ' 39' ' ' VAL . 32.1 t -61.61 -38.13 79.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.29 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.61 -56.65 23.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.821 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.586 ' HB3' HG22 ' A' ' 29' ' ' VAL . 69.7 m-20 -72.95 -41.32 64.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.74 0.305 . . . . 0.0 111.341 -179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.961 HD11 HD22 ' A' ' 42' ' ' LEU . 30.5 mt -50.33 -45.19 54.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.949 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -61.78 -46.72 88.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.699 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.481 HD13 ' OH ' ' A' ' 25' ' ' TYR . 1.6 mt -50.83 -37.69 44.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.064 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.524 HG13 HG13 ' A' ' 50' ' ' ILE . 11.2 p -101.04 -6.55 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.491 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.884 HG23 ' O ' ' A' ' 55' ' ' ARG . 7.4 mt -129.3 31.0 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 121.105 0.479 . . . . 0.0 111.303 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.474 ' N ' ' O ' ' A' ' 47' ' ' LYS . 24.3 p30 -86.68 16.2 4.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.743 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -127.33 141.21 40.14 Favored Pre-proline 0 C--N 1.334 -0.1 0 C-N-CA 120.986 -0.285 . . . . 0.0 110.659 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.435 ' HA ' HD12 ' A' ' 56' ' ' LEU . 88.8 Cg_exo -46.15 -38.49 19.58 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.267 1.978 . . . . 0.0 111.678 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.5 p -69.36 -34.77 75.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.492 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.884 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -88.4 -13.91 39.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.589 -179.72 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.653 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 17.1 mt -50.34 -50.71 69.37 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 4.3 Cg_exo -40.06 -28.83 0.29 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.291 2.661 . . . . 0.0 113.754 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.89 HD23 HG22 ' A' ' 13' ' ' VAL . 7.5 mt -65.69 -32.04 73.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.767 0.318 . . . . 0.0 111.002 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.591 ' HD1' HG21 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -60.88 -40.65 93.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.319 179.52 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.408 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -75.13 -31.36 61.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.481 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.953 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -65.12 -57.91 7.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.198 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.881 HG13 HD12 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -65.35 -35.58 75.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.749 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.466 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 7.8 ttp180 -38.55 -58.25 1.65 Allowed Pre-proline 0 N--CA 1.468 0.44 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 9.5 Cg_endo -51.92 -28.42 31.52 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.597 2.198 . . . . 0.0 112.869 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.881 HD12 HG13 ' A' ' 62' ' ' ILE . 20.4 mt -65.2 -44.5 88.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.673 0.749 . . . . 0.0 109.371 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.581 HD11 HD13 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -62.54 130.08 93.18 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.643 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -51.86 165.46 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.566 2.177 . . . . 0.0 112.218 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.56 -55.55 30.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.075 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mmtt -57.36 -54.2 49.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.034 0.445 . . . . 0.0 110.417 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 14.8 m170 -59.6 -28.32 67.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.454 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -61.72 -44.07 97.62 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 30.7 t -65.2 -45.06 94.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.275 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.11 -27.04 67.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.444 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.786 ' O ' HG23 ' A' ' 78' ' ' THR . 56.7 t80 -72.49 -46.12 56.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.517 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.21 -45.79 91.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.841 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -66.33 -40.87 90.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.064 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.462 ' CB ' HG21 ' A' ' 43' ' ' VAL . 22.9 mt -60.2 -35.53 75.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.202 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.786 HG23 ' O ' ' A' ' 74' ' ' TYR . 13.6 p -52.54 107.25 0.79 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.159 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -81.04 -167.45 0.51 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.488 2.126 . . . . 0.0 112.389 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 121.001 0.429 . . . . 0.0 110.931 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 26.0 t -173.37 -78.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.863 0.363 . . . . 0.0 110.983 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' A' ' 65' ' ' LEU . 7.9 mt -81.96 -39.95 22.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.99 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.486 ' HA ' HD13 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -53.5 -52.57 59.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 179.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.428 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -55.42 -32.74 62.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -39.27 85.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.983 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.968 HG22 ' HB1' ' A' ' 6' ' ' ALA . 21.7 t -71.03 -31.46 45.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.285 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.658 HD21 HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -68.53 -45.67 71.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.905 0.383 . . . . 0.0 110.3 179.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -69.4 -34.01 73.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.564 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.586 ' O ' HD12 ' B' ' 111' ' ' LEU . 79.0 m-20 -60.96 -45.53 94.37 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.638 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.4 ' CE2' ' HD2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -72.5 -49.37 33.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.65 179.688 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 73.3 mt -52.86 -41.56 64.42 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.807 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 21.5 mtt-85 -76.8 -36.11 57.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.542 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.586 HD12 ' O ' ' B' ' 107' ' ' ASP . 2.1 mt -73.05 -7.36 50.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.494 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 4.0 mttm -84.97 -76.45 0.31 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 121.039 0.447 . . . . 0.0 110.915 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.89 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.768 0.318 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -178.36 -39.47 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.86 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.06 -30.49 24.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.906 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.2 -39.08 81.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.056 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.0 t -55.92 -40.66 63.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.213 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.57 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -66.07 -50.85 62.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.232 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 11' ' ' HIS . 9.3 mtp180 -65.09 -26.72 68.34 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -71.01 -49.11 48.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.754 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.884 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.71 -41.61 71.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.071 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.17 92.53 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.818 178.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' A' ' 7' ' ' ARG . 12.3 m170 -59.29 -41.16 88.3 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 179.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -61.49 -34.52 75.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.171 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.806 HG13 ' CD2' ' A' ' 58' ' ' LEU . 47.8 t -62.13 -48.58 87.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -57.51 -40.18 78.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.175 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -69.06 -32.91 72.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.388 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -98.54 8.29 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.466 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.738 HG23 ' HB2' ' A' ' 22' ' ' GLU . 35.2 mm -147.68 68.56 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-O 121.721 0.772 . . . . 0.0 110.287 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -81.33 -8.82 59.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.274 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -66.93 -13.28 61.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.539 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.8 -61.61 0.49 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.609 0.242 . . . . 0.0 110.921 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.66 -48.73 66.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.916 0.388 . . . . 0.0 110.834 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.738 ' HB2' HG23 ' A' ' 17' ' ' ILE . 40.9 mt-10 -50.99 -34.45 29.13 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.78 -35.97 75.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.074 179.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.43 -44.61 86.8 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 120.998 0.428 . . . . 0.0 110.397 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 29' ' ' VAL . 13.4 t80 -60.84 -44.17 97.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.587 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.535 HD11 HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -59.29 -40.84 87.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.734 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -61.93 -41.43 97.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.768 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.36 -36.19 82.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.581 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.834 HG11 ' HG ' ' A' ' 46' ' ' LEU . 41.1 t -69.76 -36.63 70.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.835 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.78 HD21 HD11 ' A' ' 62' ' ' ILE . 11.4 mt -70.24 -43.59 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.652 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.5 ttt85 -66.81 -35.45 80.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.485 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 23.7 tpp -69.14 -43.76 73.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.397 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.659 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.3 t80 -62.13 -39.64 93.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.905 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.489 ' HD2' HD11 ' B' ' 101' ' ' LEU . 58.8 t-80 -74.86 -41.38 59.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.399 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -54.99 5.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.855 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.1 p -76.53 -23.14 53.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.84 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.437 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.5 mmt 63.64 18.38 11.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.771 0.319 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.618 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.0 OUTLIER -97.87 116.6 30.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.757 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.794 ' O ' HG23 ' A' ' 43' ' ' VAL . 19.5 t -79.41 -21.41 12.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.203 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.33 -30.81 54.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.877 0.37 . . . . 0.0 110.697 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.618 HG23 ' HB3' ' A' ' 38' ' ' ASP . 40.8 t -73.55 -41.88 55.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.677 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.685 HD12 HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -69.75 -38.09 76.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.696 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 39' ' ' VAL . 76.4 t -65.87 -37.21 79.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 CA-C-O 120.961 0.41 . . . . 0.0 110.212 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.04 -57.98 13.65 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.962 179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -60.92 -44.37 97.28 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.021 0.438 . . . . 0.0 110.472 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.834 ' HG ' HG11 ' A' ' 29' ' ' VAL . 10.7 mt -51.02 -40.73 58.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.464 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.3 OUTLIER -59.34 -50.24 74.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 0.0 110.271 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mp -51.45 -37.25 47.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.811 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.609 HG13 HG13 ' A' ' 50' ' ' ILE . 14.9 p -101.0 3.7 10.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.435 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.855 HG23 ' O ' ' A' ' 55' ' ' ARG . 71.3 mt -140.4 29.64 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' A' ' 47' ' ' LYS . 27.0 m-20 -84.32 11.19 8.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.871 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.417 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 20.1 mm-40 -127.3 148.76 67.53 Favored Pre-proline 0 C--O 1.231 0.103 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.807 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.451 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.69 -37.8 65.0 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.45 2.1 . . . . 0.0 111.445 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.29 -32.49 71.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.296 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.855 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.9 mtp180 -91.31 -9.22 45.81 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.391 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.5 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 18.1 mt -57.01 -44.55 99.83 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.718 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 85.7 Cg_exo -43.17 -27.34 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.689 2.26 . . . . 0.0 113.577 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.806 ' CD2' HG13 ' A' ' 13' ' ' VAL . 15.8 mt -70.51 -30.27 66.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.692 0.282 . . . . 0.0 111.037 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.486 ' HE1' ' HH ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.893 0.378 . . . . 0.0 110.637 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.419 ' O ' ' HD2' ' A' ' 64' ' ' PRO . 3.0 m-20 -75.48 -31.27 60.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.805 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.884 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -65.57 -64.49 0.85 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.453 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.78 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.7 -28.32 44.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.743 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.447 ' HG2' ' CE2' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -41.72 -63.96 0.75 Allowed Pre-proline 0 CA--C 1.537 0.475 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -178.857 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.43 ' HG2' ' O ' ' A' ' 61' ' ' ALA . 2.4 Cg_endo -46.25 -26.98 4.26 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.963 2.442 . . . . 0.0 113.214 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.572 HD12 ' CG1' ' A' ' 62' ' ' ILE . 16.1 mt -65.41 -51.86 57.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 109.542 179.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.445 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.0 OUTLIER -47.68 129.89 11.05 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.7 -1.137 . . . . 0.0 111.156 179.458 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.443 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 53.7 Cg_exo -52.86 165.8 1.08 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.693 2.262 . . . . 0.0 112.418 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.9 mt -54.94 -56.85 15.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.135 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -54.6 44.58 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.249 0.547 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.445 ' CB ' HG23 ' A' ' 66' ' ' ILE . 20.1 m170 -57.54 -29.35 64.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.219 179.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.74 -44.26 96.66 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.846 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -59.29 -46.68 92.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.824 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.47 -31.13 71.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.99 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.651 ' HE1' HD11 ' A' ' 42' ' ' LEU . 2.3 t80 -59.99 -49.79 76.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.354 179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -59.46 -48.26 82.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.76 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -66.3 -19.11 65.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.512 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.407 ' HB3' HG11 ' A' ' 43' ' ' VAL . 44.7 mt -89.03 -24.71 22.27 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.615 ' N ' ' HD2' ' A' ' 79' ' ' PRO . 2.3 p -57.51 -44.94 99.86 Favored Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.615 ' HD2' ' N ' ' A' ' 78' ' ' THR . 44.0 Cg_endo -67.76 -26.82 38.45 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 121.882 1.721 . . . . 0.0 112.231 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.949 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' B' ' 100' ' ' LEU . 22.9 t -110.57 177.16 4.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.631 0.253 . . . . 0.0 110.855 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' B' ' 99' ' ' SER . 17.5 mt 68.06 -57.57 0.47 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.718 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.609 HD22 ' CE2' ' A' ' 33' ' ' TYR . 1.8 pp -51.59 -40.58 60.09 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.764 0.316 . . . . 0.0 110.871 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -33.84 74.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.329 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.04 -32.43 70.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.569 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.705 HG11 ' CZ ' ' A' ' 9' ' ' PHE . 2.0 t -68.78 -39.92 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.48 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.57 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.5 OUTLIER -65.12 -45.64 84.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.334 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -33.83 73.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.616 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.46 -50.48 73.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.735 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' B' ' 112' ' ' LYS . 0.3 OUTLIER -70.58 -46.14 64.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.691 179.796 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 11.0 mt -51.12 -37.62 47.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.521 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -76.94 -35.54 57.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.922 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.15 -15.76 62.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.194 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' B' ' 108' ' ' TYR . 5.1 mmmm -70.49 -73.85 0.16 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-O 120.957 0.408 . . . . 0.0 110.771 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.915 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.785 0.326 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.467 ' O ' HD21 ' B' ' 100' ' ' LEU . 17.3 p30 -147.05 29.94 0.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.959 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -92.04 -36.75 13.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.836 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -33.52 71.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.3 t -57.78 -38.34 64.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.26 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.788 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -68.1 -50.94 51.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.15 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -26.7 67.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.174 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.19 -48.27 52.55 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.461 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.738 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -70.77 -43.2 69.27 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.744 ' NH1' HD13 ' B' ' 111' ' ' LEU . 1.2 ttp180 -58.05 -42.18 84.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.696 178.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.04 -44.65 94.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.436 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HD2' ' HA ' ' A' ' 9' ' ' PHE . 0.0 OUTLIER -61.58 -32.56 72.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.215 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 9' ' ' PHE . 49.0 t -62.32 -49.37 84.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.123 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -57.65 -37.94 74.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.851 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.92 -41.81 77.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.336 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.5 ' O ' HD13 ' A' ' 17' ' ' ILE . 3.4 mt -87.42 4.89 41.42 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.357 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.654 HG22 ' O ' ' A' ' 17' ' ' ILE . 41.6 mm -143.0 67.07 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-O 121.785 0.802 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -54.41 -31.25 54.7 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.975 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -73.13 164.64 26.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.619 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.32 -28.68 13.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.991 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.54 -51.64 67.74 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 110.949 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.533 ' HB2' HG23 ' A' ' 17' ' ' ILE . 27.4 mt-10 -50.9 -34.77 29.79 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 17.9 mttt -71.53 -34.9 70.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.966 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.97 -42.87 99.18 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -67.87 -40.5 83.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 179.451 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.504 HD22 HG11 ' A' ' 13' ' ' VAL . 0.1 OUTLIER -61.22 -46.03 92.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.63 179.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 15.4 m-30 -60.51 -42.65 96.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.729 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.73 -37.68 88.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.709 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 25' ' ' TYR . 46.6 t -63.62 -51.82 65.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.894 HD21 HD11 ' A' ' 62' ' ' ILE . 6.2 mt -60.56 -37.87 82.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.606 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.2 mmt-85 -65.23 -41.24 94.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.383 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.9 mmt -64.09 -46.83 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.462 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.692 ' CE1' HG22 ' A' ' 39' ' ' VAL . 13.0 t80 -59.59 -37.79 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.043 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -74.71 -44.76 48.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.563 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -55.15 5.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.151 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -75.21 -20.78 59.09 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.413 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 1.3 mmt 61.11 20.15 10.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.68 0.276 . . . . 0.0 110.7 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.485 ' HB3' HG23 ' A' ' 41' ' ' VAL . 3.9 t0 -104.73 120.68 41.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.91 0.386 . . . . 0.0 110.864 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.831 ' O ' HG23 ' A' ' 43' ' ' VAL . 44.5 t -79.67 -16.61 13.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.21 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.51 -28.45 56.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.879 0.371 . . . . 0.0 110.947 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.485 HG23 ' HB3' ' A' ' 38' ' ' ASP . 53.2 t -73.18 -45.25 54.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.751 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.736 ' HA ' HG13 ' A' ' 29' ' ' VAL . 2.4 pp -67.92 -38.6 83.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.751 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 39' ' ' VAL . 71.2 t -61.03 -38.99 80.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.003 0.43 . . . . 0.0 110.372 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.71 -59.19 8.47 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.157 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.466 ' CB ' HG22 ' A' ' 29' ' ' VAL . 76.6 m-20 -60.53 -45.03 95.33 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.781 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.811 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.9 mt -50.81 -44.48 59.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' ASN . 2.2 tppt? -57.91 -46.61 84.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.567 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.09 -37.64 64.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.736 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.5 p -100.97 2.87 10.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.468 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.874 HG23 ' O ' ' A' ' 55' ' ' ARG . 53.2 mt -139.13 29.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.406 0.622 . . . . 0.0 110.955 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.478 ' N ' ' O ' ' A' ' 47' ' ' LYS . 28.6 p30 -86.28 17.65 3.59 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.873 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.431 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 24.2 mm-40 -126.03 141.22 38.94 Favored Pre-proline 0 N--CA 1.458 -0.05 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.439 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.464 ' HA ' HD12 ' A' ' 56' ' ' LEU . 85.4 Cg_exo -45.42 -38.9 16.24 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.157 1.905 . . . . 0.0 111.884 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.2 t -69.4 -36.03 76.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.851 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.874 ' O ' HG23 ' A' ' 50' ' ' ILE . 61.0 mtt85 -87.82 -15.73 36.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.768 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.653 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 15.8 mt -46.54 -51.92 33.35 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.0 Cg_exo -39.13 -29.17 0.18 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.358 2.706 . . . . 0.0 113.739 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.591 HD21 HG13 ' A' ' 13' ' ' VAL . 1.0 OUTLIER -60.61 -30.14 69.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.821 0.344 . . . . 0.0 111.041 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.634 ' HD1' HG21 ' A' ' 50' ' ' ILE . 2.0 m-85 -69.61 -40.32 76.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 7.1 m-20 -75.28 -31.07 60.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.937 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.604 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.93 -61.85 1.63 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.047 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.894 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -58.34 -36.17 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.968 -179.27 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 17.9 ttp180 -41.35 -66.68 0.37 Allowed Pre-proline 0 CA--C 1.538 0.487 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.11 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 88.9 Cg_exo -34.55 -33.62 0.08 OUTLIER 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 123.309 2.673 . . . . 0.0 113.497 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.481 HD11 ' CE2' ' A' ' 9' ' ' PHE . 6.8 mt -64.77 -53.59 44.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 110.141 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.622 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.6 OUTLIER -38.74 128.89 1.15 Allowed Pre-proline 0 CA--C 1.537 0.463 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.647 179.595 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.405 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 50.8 Cg_exo -54.08 165.7 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.687 2.258 . . . . 0.0 112.251 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.9 mt -52.21 -51.28 59.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.264 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.628 ' O ' HG12 ' A' ' 72' ' ' VAL . 7.7 mmtm -57.89 -60.11 4.22 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.218 0.532 . . . . 0.0 110.387 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.622 ' HB2' HG23 ' A' ' 66' ' ' ILE . 18.5 m170 -60.12 -19.87 55.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.618 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.21 -53.55 29.19 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.628 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.4 p -61.65 -35.26 66.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.248 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -70.92 -42.99 69.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.088 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.919 ' O ' HG23 ' A' ' 78' ' ' THR . 87.9 t80 -63.94 -44.46 92.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.232 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -39.72 85.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.396 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.447 ' OE1' HG22 ' A' ' 72' ' ' VAL . 29.9 mt-30 -59.22 -48.92 79.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.323 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' A' ' 74' ' ' TYR . 2.1 mt -62.72 -32.33 73.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.596 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.919 HG23 ' O ' ' A' ' 74' ' ' TYR . 5.7 p -88.02 155.63 52.4 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.798 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' A' ' 78' ' ' THR . 16.5 Cg_endo -57.6 107.48 0.3 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.542 2.161 . . . . 0.0 112.223 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.038 -179.957 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 69.3 p -138.06 67.92 1.41 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.974 0.416 . . . . 0.0 110.861 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.467 HD21 ' O ' ' A' ' 2' ' ' ASP . 6.0 mt -61.23 -48.39 81.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.836 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.618 HD13 HD21 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -51.76 -53.03 44.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -60.48 -31.81 70.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.777 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.56 -40.04 93.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.76 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.788 HG22 ' HB1' ' A' ' 6' ' ' ALA . 9.4 t -71.06 -40.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.856 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.618 HD21 HD13 ' B' ' 101' ' ' LEU . 1.1 mt -63.33 -45.7 90.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.035 0.445 . . . . 0.0 109.981 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -60.39 -38.69 84.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.466 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -60.93 -41.96 97.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.572 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.451 ' CZ ' ' HG2' ' A' ' 10' ' ' ARG . 3.4 m-85 -70.18 -48.46 57.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.682 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 13.6 mt -51.35 -39.75 57.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.769 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 14.3 mtt-85 -76.75 -36.31 57.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.488 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.744 HD13 ' NH1' ' A' ' 10' ' ' ARG . 0.5 OUTLIER -70.96 -9.33 57.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.539 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -78.5 -77.82 0.16 Allowed 'General case' 0 N--CA 1.457 -0.092 0 CA-C-O 120.857 0.36 . . . . 0.0 110.869 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.5 mttp . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.979 179.921 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.601 ' HA ' HD11 ' B' ' 100' ' ' LEU . 16.4 mtt . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.869 0.366 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -161.56 177.83 9.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.927 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.36 -36.45 76.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.74 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -65.0 -35.41 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.841 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.467 HG21 ' N ' ' A' ' 1' ' ' MET . 26.2 t -61.75 -35.05 65.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.202 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.055 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -68.69 -50.97 46.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.209 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 2.8 ttp180 -63.9 -26.84 68.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.422 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.73 -49.32 48.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.66 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.93 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.6 -43.36 72.94 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' HG3' ' CZ ' ' B' ' 108' ' ' TYR . 0.0 OUTLIER -56.63 -44.76 81.57 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.933 178.401 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 5.4 t-160 -58.24 -42.75 87.03 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 109.817 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -59.62 -32.96 70.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.199 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.594 HG13 ' CD2' ' A' ' 58' ' ' LEU . 44.9 t -64.57 -47.58 88.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.58 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -57.6 -41.07 80.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.382 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.97 -31.42 70.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.742 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.0 mt -101.4 8.96 41.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.611 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 17' ' ' ILE . 37.4 mm -149.06 69.04 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.94 0 CA-C-O 121.701 0.763 . . . . 0.0 110.148 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.81 -36.13 76.11 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.789 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -63.79 150.17 45.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.672 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -86.89 -30.18 21.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.091 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.61 -52.63 63.57 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.004 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.544 ' CD ' HD12 ' A' ' 17' ' ' ILE . 17.2 mt-10 -50.88 -34.7 29.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 82.2 mttt -72.74 -34.27 66.92 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.89 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.1 -45.5 88.38 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.153 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.924 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.8 OUTLIER -62.49 -42.81 99.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.158 179.308 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.69 HD12 HG11 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -58.18 -40.99 82.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.441 179.405 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 13.4 m-30 -61.01 -43.03 99.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.293 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -68.61 -36.69 79.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.608 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 25' ' ' TYR . 32.6 t -64.56 -50.43 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.705 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.016 HD21 HD11 ' A' ' 62' ' ' ILE . 18.0 mt -60.62 -40.66 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.514 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.71 -39.07 87.18 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.329 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 4.6 mmt -60.71 -52.08 66.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.349 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.595 ' CG ' HD11 ' A' ' 42' ' ' LEU . 8.7 t80 -53.53 -40.82 65.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.323 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -74.39 -38.2 63.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.86 0.362 . . . . 0.0 111.354 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -54.87 5.89 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -86.22 -25.56 25.54 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.52 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 8.4 mmt 61.56 35.11 17.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 110.655 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.51 ' HB3' HG23 ' A' ' 41' ' ' VAL . 9.7 t0 -114.97 124.56 51.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.855 ' O ' HG23 ' A' ' 43' ' ' VAL . 15.8 t -76.74 -12.64 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.192 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.15 -36.05 55.58 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 120.948 0.404 . . . . 0.0 110.287 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.51 HG23 ' HB3' ' A' ' 38' ' ' ASP . 34.8 t -70.13 -34.93 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.129 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.78 ' CD2' HG12 ' A' ' 29' ' ' VAL . 7.3 mt -66.61 -49.18 67.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.585 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 39' ' ' VAL . 26.2 t -58.15 -37.48 62.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.073 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.26 -59.58 8.74 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.826 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.593 ' HA ' HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -68.07 -42.93 79.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.889 0.376 . . . . 0.0 111.21 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' A' ' 50' ' ' ILE . 41.7 mt -50.45 -47.53 56.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -58.27 -45.23 88.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 45' ' ' ASP . 3.1 mt -53.21 -40.88 64.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.69 HG11 HD12 ' A' ' 26' ' ' LEU . 14.8 p -101.08 4.22 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.449 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.874 HG23 ' O ' ' A' ' 55' ' ' ARG . 60.0 mt -140.2 29.55 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.217 0.532 . . . . 0.0 111.219 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.481 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.4 p30 -89.2 15.73 8.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.628 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -129.59 150.12 74.8 Favored Pre-proline 0 C--N 1.333 -0.132 0 C-N-CA 121.126 -0.229 . . . . 0.0 110.491 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.478 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.68 -38.69 66.61 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.325 2.017 . . . . 0.0 111.429 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 t -69.42 -36.8 77.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.608 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.874 ' O ' HG23 ' A' ' 50' ' ' ILE . 53.5 mtt85 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.647 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.682 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.1 mt -53.45 -49.78 86.55 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.682 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.7 Cg_endo -41.16 -27.91 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.022 2.482 . . . . 0.0 113.493 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.594 ' CD2' HG13 ' A' ' 13' ' ' VAL . 6.7 mt -70.74 -35.27 72.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.782 0.325 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.428 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -58.04 -44.73 87.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.265 179.325 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.2 OUTLIER -75.31 -31.08 60.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.675 179.512 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.93 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.31 -59.85 4.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 1.016 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.52 -38.04 76.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.773 -0.648 . . . . 0.0 112.34 -179.241 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.453 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.4 OUTLIER -38.13 -66.29 0.31 Allowed Pre-proline 0 N--CA 1.469 0.476 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 82.3 Cg_exo -38.69 -32.12 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.835 2.357 . . . . 0.0 113.512 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.87 HD12 HG13 ' A' ' 62' ' ' ILE . 19.4 mt -65.44 -46.47 79.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.656 0.741 . . . . 0.0 109.851 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.472 HG13 ' CE2' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -54.52 133.47 63.4 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.18 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.74 165.56 0.73 Allowed 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.496 2.131 . . . . 0.0 112.168 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.2 tp -56.59 -57.09 13.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.979 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -57.86 -52.17 66.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.117 0.485 . . . . 0.0 110.388 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CB ' HG23 ' A' ' 66' ' ' ILE . 22.7 m170 -59.45 -29.67 67.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.452 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.26 -43.5 98.7 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.188 179.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.8 -45.87 97.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.118 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -39.14 93.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.072 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 78' ' ' THR . 53.5 t80 -59.85 -40.34 88.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.324 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.94 -53.39 57.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.561 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -66.71 -15.45 63.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.266 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.716 ' HB3' HG21 ' A' ' 43' ' ' VAL . 42.9 mt -91.96 -20.8 21.0 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 74' ' ' TYR . 7.4 p -56.89 -39.22 76.35 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.541 ' CD ' ' N ' ' A' ' 78' ' ' THR . 52.1 Cg_exo -55.1 -50.62 12.52 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.026 1.817 . . . . 0.0 112.286 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.769 -0.132 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.1 m 63.24 90.56 0.08 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.924 0.392 . . . . 0.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.601 HD11 ' HA ' ' A' ' 1' ' ' MET . 28.4 mt -93.93 -28.5 15.78 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.005 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.65 ' HA ' HD13 ' A' ' 65' ' ' LEU . 0.4 OUTLIER -52.02 -39.47 59.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.843 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.43 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 28.2 ttpp -61.01 -42.46 98.5 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.598 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.23 -38.48 83.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.897 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.055 HG22 ' HB1' ' A' ' 6' ' ' ALA . 23.8 t -68.03 -37.08 77.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.362 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.526 HD22 ' HB3' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -61.92 -44.06 97.56 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 178.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.51 -36.82 84.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.606 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -60.03 -40.32 88.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.457 ' CZ ' ' HG3' ' A' ' 10' ' ' ARG . 4.8 m-85 -73.53 -45.71 52.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.78 179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 5.8 mt -51.01 -41.64 59.9 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.565 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -76.89 -34.32 57.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.119 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.4 -18.1 60.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.184 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -87.7 -47.05 8.96 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 121.004 0.43 . . . . 0.0 110.879 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.818 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.795 0.331 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.627 ' CB ' HD21 ' B' ' 100' ' ' LEU . 5.3 m-20 -132.43 31.64 4.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.89 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.1 ttt-85 -83.56 -31.89 26.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.959 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -35.43 81.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.39 -40.13 85.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.99 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.701 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.78 -50.95 54.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 11' ' ' HIS . 5.7 ttp180 -66.15 -26.9 67.64 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.12 179.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -71.69 -48.93 44.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.408 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.644 ' CZ ' HG11 ' B' ' 104' ' ' VAL . 0.1 OUTLIER -69.5 -43.02 73.98 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -43.3 90.17 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.664 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.409 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 17.3 t-160 -57.27 -42.26 81.3 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.866 178.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -59.32 -36.81 76.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.157 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.88 HG22 HD22 ' A' ' 58' ' ' LEU . 46.2 t -60.24 -46.68 94.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.315 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -57.6 -41.48 81.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.153 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.0 -31.77 70.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.603 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.5 mt -97.18 6.03 49.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.406 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.663 HG22 ' O ' ' A' ' 17' ' ' ILE . 37.5 mm -145.32 67.78 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 121.721 0.772 . . . . 0.0 110.029 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.64 -33.81 61.17 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.927 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.48 165.8 13.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.654 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -101.65 -32.97 10.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.985 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.19 74.37 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.419 ' HB2' HG23 ' A' ' 17' ' ' ILE . 5.1 mt-10 -50.77 -34.57 27.8 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 36.5 mttt -72.91 -34.82 66.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.897 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -63.78 -42.69 97.71 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.227 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.838 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 t80 -64.83 -45.16 87.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' HG21 ' A' ' 49' ' ' VAL . 7.9 mt -60.66 -38.98 86.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.501 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 21.7 m-85 -61.34 -44.63 96.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.588 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.68 -33.96 77.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.597 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.838 HG23 ' O ' ' A' ' 25' ' ' TYR . 42.3 t -65.52 -47.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.796 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.021 HD21 HD11 ' A' ' 62' ' ' ILE . 6.2 mt -61.84 -42.71 99.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.661 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.18 -40.87 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.493 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -47.02 86.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.144 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.78 ' CD2' HD22 ' B' ' 101' ' ' LEU . 4.9 t80 -55.58 -46.45 77.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.875 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -74.9 -33.63 62.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.578 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -77.3 -55.05 5.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.9 p -89.51 -10.82 44.83 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.444 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.8 mmt 59.63 24.51 13.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.731 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.76 ' HB3' HG23 ' A' ' 41' ' ' VAL . 5.1 m-20 -101.09 117.44 35.03 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.975 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.817 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.3 t -79.86 -21.93 11.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.009 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.61 -28.43 56.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.766 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.76 HG23 ' HB3' ' A' ' 38' ' ' ASP . 43.7 t -73.46 -44.19 54.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.759 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 46' ' ' LEU . 2.4 pp -68.4 -38.39 81.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.74 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.817 HG23 ' O ' ' A' ' 39' ' ' VAL . 91.5 t -63.95 -42.28 95.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.0 0.428 . . . . 0.0 110.336 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.81 -58.36 14.63 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.165 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.403 ' CB ' HG22 ' A' ' 29' ' ' VAL . 6.2 m-20 -60.54 -40.17 90.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.975 0.417 . . . . 0.0 110.709 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 42' ' ' LEU . 12.3 mt -51.9 -43.19 63.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.608 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HD3' ' CZ ' ' A' ' 59' ' ' PHE . 1.6 tppt? -57.9 -47.48 82.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.14 0.495 . . . . 0.0 110.514 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -54.25 -36.39 63.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.71 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.566 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.9 p -101.22 2.25 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.553 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.908 HG23 ' O ' ' A' ' 55' ' ' ARG . 53.4 mt -140.15 29.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-O 121.29 0.566 . . . . 0.0 110.869 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.473 ' N ' ' O ' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -87.24 17.59 4.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.966 -179.869 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.407 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 3.5 mt-10 -128.36 142.2 43.9 Favored Pre-proline 0 CA--C 1.523 -0.07 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.54 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.575 ' HA ' HD12 ' A' ' 56' ' ' LEU . 81.8 Cg_exo -46.75 -38.26 22.38 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.148 1.899 . . . . 0.0 111.498 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -35.66 76.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.583 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.908 ' O ' HG23 ' A' ' 50' ' ' ILE . 18.9 mtt85 -90.83 -7.22 52.91 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.808 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 53' ' ' PRO . 13.3 mt -57.15 -46.02 99.88 Favored Pre-proline 0 CA--C 1.531 0.244 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.49 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 91.2 Cg_exo -43.77 -26.76 1.33 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.766 2.31 . . . . 0.0 113.729 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.88 HD22 HG22 ' A' ' 13' ' ' VAL . 8.5 mt -73.44 -30.29 63.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.757 0.313 . . . . 0.0 111.015 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.615 ' CE2' HG22 ' A' ' 78' ' ' THR . 0.1 OUTLIER -60.99 -48.45 81.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.618 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.442 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 0.9 OUTLIER -75.19 -31.0 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.77 179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.483 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -60.73 -58.2 9.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.776 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 1.021 HD11 HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.92 -36.85 77.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.957 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.436 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 1.1 ttp85 -36.5 -62.82 0.49 Allowed Pre-proline 0 N--CA 1.469 0.489 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.454 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.6 Cg_exo -33.97 -36.32 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 123.406 2.737 . . . . 0.0 113.545 -179.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.723 HD11 HG21 ' B' ' 104' ' ' VAL . 15.2 mt -65.09 -56.8 10.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.413 0.625 . . . . 0.0 109.951 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.457 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -44.24 133.65 4.4 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.187 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -50.94 165.34 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.607 2.205 . . . . 0.0 112.437 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.98 -55.38 33.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.05 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.626 ' O ' HG12 ' A' ' 72' ' ' VAL . 19.1 tttm -57.52 -53.97 52.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.178 0.513 . . . . 0.0 110.342 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.537 ' CG ' HG21 ' A' ' 39' ' ' VAL . 44.5 m170 -60.99 -22.22 64.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.482 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.11 -54.93 16.78 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.974 0.416 . . . . 0.0 110.454 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.4 p -59.18 -35.11 55.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.183 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -68.47 -37.37 80.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.968 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 78' ' ' THR . 9.5 t80 -63.34 -37.91 89.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.216 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.21 -43.46 86.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.621 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -66.61 -26.67 67.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.22 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.6 mt -86.96 -25.68 24.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.933 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.918 HG23 ' O ' ' A' ' 74' ' ' TYR . 66.7 p -55.28 -45.27 99.88 Favored Pre-proline 0 CA--C 1.534 0.337 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' A' ' 78' ' ' THR . 23.2 Cg_endo -60.58 162.41 18.09 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.928 1.752 . . . . 0.0 112.257 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.911 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m 61.68 29.29 18.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.8 0.334 . . . . 0.0 111.074 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.627 HD21 ' CB ' ' A' ' 2' ' ' ASP . 10.9 mt -90.29 -29.05 18.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.972 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.78 HD22 ' CD2' ' A' ' 33' ' ' TYR . 53.2 tp -51.77 -52.76 46.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.459 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -57.15 -31.57 65.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.595 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.22 -40.26 95.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.723 HG21 HD11 ' A' ' 65' ' ' LEU . 2.0 t -70.94 -36.17 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.929 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.574 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.3 OUTLIER -72.0 -45.51 60.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.847 0.356 . . . . 0.0 110.484 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -70.06 -33.82 72.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.774 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -64.74 -45.36 86.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.756 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -50.66 45.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.735 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.529 HD23 ' HE3' ' B' ' 112' ' ' LYS . 55.2 mt -51.06 -40.68 58.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.472 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -77.46 -35.72 53.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.273 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -21.98 51.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.136 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . 0.529 ' HE3' HD23 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -100.98 -29.73 12.03 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.029 179.384 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.6 mttp . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.917 179.976 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.7 mtp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.795 0.331 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.626 ' HB3' HD21 ' B' ' 100' ' ' LEU . 0.3 OUTLIER 61.12 110.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.877 -179.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.7 mtt85 -160.96 -43.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.975 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -33.58 71.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.514 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.04 -39.3 71.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.1 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.987 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.09 -50.91 60.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -64.91 -26.9 68.51 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.188 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -70.61 -49.12 51.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.526 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.81 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.75 -43.57 72.0 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.083 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.899 ' CZ ' HD13 ' B' ' 111' ' ' LEU . 0.1 OUTLIER -58.93 -41.82 88.23 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.736 178.488 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 -58.7 -42.3 88.27 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.784 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -59.91 -36.0 76.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.01 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 9' ' ' PHE . 45.0 t -60.5 -49.09 85.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.519 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -57.63 -38.74 75.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.308 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.95 -35.3 76.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.421 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 17' ' ' ILE . 74.2 mt -95.25 5.44 51.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.46 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.585 HG22 ' O ' ' A' ' 17' ' ' ILE . 40.5 mm -147.61 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-O 121.611 0.719 . . . . 0.0 110.224 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -56.42 -39.72 73.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.891 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.17 179.17 0.15 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.681 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -111.44 -32.26 6.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.2 -53.02 62.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.538 ' HB2' HG23 ' A' ' 17' ' ' ILE . 37.5 mt-10 -50.81 -35.04 30.09 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 7.2 mttt -73.25 -34.26 65.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.904 178.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.48 -41.27 98.57 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.002 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.638 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -65.08 -46.07 82.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.218 179.33 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.429 HD22 HG11 ' A' ' 13' ' ' VAL . 5.1 tp -60.55 -36.6 78.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.65 ' HA ' HD12 ' A' ' 30' ' ' LEU . 21.8 m-85 -62.83 -44.86 95.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.615 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.2 -40.55 90.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.548 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 25' ' ' TYR . 22.2 t -60.29 -47.88 90.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.921 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.846 HD21 HD11 ' A' ' 62' ' ' ILE . 4.8 mt -59.87 -44.71 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.45 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -32.99 69.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.348 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.445 ' O ' ' N ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -64.48 -55.36 21.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.283 179.563 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.485 ' HB3' HD21 ' B' ' 101' ' ' LEU . 0.1 OUTLIER -53.45 -34.45 57.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -74.85 -53.38 9.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.523 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.27 -55.18 5.64 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' MET . 17.8 p -86.67 -47.64 8.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.658 0.266 . . . . 0.0 111.583 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 75.45 32.41 0.72 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.863 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.709 ' O ' HD12 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -101.24 120.19 39.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.749 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.915 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.3 t -78.22 -16.54 13.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.252 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -36.55 53.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.99 0.424 . . . . 0.0 110.327 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 38' ' ' ASP . 26.3 t -72.81 -34.17 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.018 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.709 HD12 ' O ' ' A' ' 38' ' ' ASP . 0.2 OUTLIER -67.9 -44.31 77.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.89 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.915 HG23 ' O ' ' A' ' 39' ' ' VAL . 59.5 t -57.46 -40.0 72.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.816 0.341 . . . . 0.0 110.925 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.49 -57.68 10.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.757 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.46 ' HB3' HG22 ' A' ' 29' ' ' VAL . 2.1 m-20 -63.61 -48.91 75.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.999 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HG ' HG11 ' A' ' 29' ' ' VAL . 51.2 mt -50.48 -44.45 55.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.016 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -60.39 -46.64 89.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.094 0.473 . . . . 0.0 110.463 179.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 mt -51.98 -37.63 53.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.699 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.584 HG13 HG13 ' A' ' 50' ' ' ILE . 14.8 p -101.11 1.74 10.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.454 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.868 HG23 ' O ' ' A' ' 55' ' ' ARG . 58.3 mt -135.13 27.41 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.304 0.573 . . . . 0.0 111.136 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 23.2 m-20 -84.39 12.08 7.4 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.885 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -126.29 145.41 52.53 Favored Pre-proline 0 C--O 1.231 0.11 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.767 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.425 ' HA ' HD12 ' A' ' 56' ' ' LEU . 71.9 Cg_exo -47.95 -38.81 31.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.318 2.012 . . . . 0.0 111.692 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 p -69.27 -35.94 76.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.545 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.868 ' O ' HG23 ' A' ' 50' ' ' ILE . 63.3 mtt85 -88.02 -8.55 55.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.636 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.636 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 16.6 mt -55.43 -53.48 61.71 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.531 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.636 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 6.2 Cg_exo -39.04 -29.19 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.362 2.708 . . . . 0.0 113.641 -179.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.714 HD12 HG12 ' A' ' 50' ' ' ILE . 35.7 mt -60.94 -37.03 80.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -44.1 97.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.585 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.447 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.9 m-20 -75.0 -31.18 61.34 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.647 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.81 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.82 -62.31 1.73 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.752 -179.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.846 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.84 -35.06 71.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.055 -179.173 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.479 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 5.8 ttt-85 -38.05 -65.32 0.38 Allowed Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 76.7 Cg_exo -36.16 -33.7 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 123.084 2.523 . . . . 0.0 113.406 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.607 HD11 ' CE2' ' A' ' 9' ' ' PHE . 16.5 mt -65.14 -51.68 59.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.349 0.595 . . . . 0.0 110.128 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.522 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -45.08 132.15 5.47 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.351 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.472 ' HG2' ' HB2' ' A' ' 70' ' ' HIS . 2.8 Cg_endo -48.25 165.68 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.61 2.206 . . . . 0.0 112.123 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.1 tp -55.39 -56.12 23.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.419 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.1 pttt -56.3 -52.62 63.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.522 ' CB ' HG23 ' A' ' 66' ' ' ILE . 25.0 m170 -62.88 -29.19 70.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.477 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.03 -43.88 87.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.016 0.436 . . . . 0.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 t -67.85 -47.76 78.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.269 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -64.81 -27.9 69.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.508 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.816 ' O ' HG23 ' A' ' 78' ' ' THR . 23.0 t80 -69.37 -48.32 61.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.694 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -60.99 -39.01 88.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.631 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -61.97 -47.28 85.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.776 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 23.3 mt -68.02 -34.8 77.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.955 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.816 HG23 ' O ' ' A' ' 74' ' ' TYR . 68.4 p -74.36 154.48 88.02 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.932 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.407 ' HD2' ' HB ' ' A' ' 78' ' ' THR . 34.9 Cg_endo -64.65 98.35 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.475 2.117 . . . . 0.0 112.323 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.848 179.995 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 112.548 -0.221 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -125.92 30.68 5.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.771 0.32 . . . . 0.0 110.937 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' A' ' 2' ' ' ASP . 6.3 mt -131.54 -40.84 1.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.187 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.513 ' HA ' HD13 ' A' ' 65' ' ' LEU . 40.5 tp -51.92 -52.62 48.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.99 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.424 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.0 OUTLIER -54.99 -35.35 64.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.923 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.04 -38.57 91.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.995 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.987 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.1 t -69.8 -34.24 59.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.102 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.492 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.1 mt -64.44 -45.61 86.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.957 0.408 . . . . 0.0 109.959 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -35.19 80.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.566 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -62.63 -39.15 92.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.575 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.453 ' CE2' ' HG3' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -71.05 -52.9 16.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.737 179.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.445 ' HA ' HD23 ' B' ' 109' ' ' LEU . 11.6 mt -51.02 -35.7 35.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.769 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -76.89 -36.22 56.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.175 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.899 HD13 ' CZ ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -71.03 -10.66 60.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.293 178.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 27.5 mmtt -79.48 -54.28 6.07 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.02 0.438 . . . . 0.0 110.762 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.963 179.913 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.98 0.419 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 3' ' ' ARG . 3.7 m-20 -142.91 149.84 39.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.821 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 2' ' ' ASP . 0.9 OUTLIER 68.76 -57.22 0.51 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.643 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -34.75 72.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.811 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.42 -37.58 80.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.025 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.04 -49.84 53.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.717 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -26.71 68.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.335 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -70.06 -49.31 52.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.449 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.608 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -69.86 -42.54 73.38 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.618 ' NH2' HD22 ' B' ' 111' ' ' LEU . 22.1 ttp85 -57.47 -44.1 84.6 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.664 178.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 18.3 t-160 -57.8 -43.33 85.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.209 0.528 . . . . 0.0 109.789 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -59.18 -35.23 73.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.193 179.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.806 HG22 ' CD2' ' A' ' 58' ' ' LEU . 61.5 t -62.05 -46.65 96.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.271 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -57.59 -39.3 76.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.005 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -69.07 -36.1 77.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.541 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.401 HD13 ' HG2' ' A' ' 57' ' ' PRO . 14.6 mt -96.49 8.39 44.21 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.572 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.666 HG22 ' O ' ' A' ' 17' ' ' ILE . 34.5 mm -150.06 69.53 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-O 121.625 0.726 . . . . 0.0 109.986 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -58.85 -33.52 70.53 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.03 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -60.89 175.47 0.49 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -110.26 -30.44 7.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.71 -51.23 63.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.973 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' A' ' 17' ' ' ILE . 35.1 mt-10 -50.78 -34.69 28.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 73.4 mttt -72.14 -35.5 69.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.003 178.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.45 -40.66 97.35 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.049 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.898 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -66.5 -43.93 83.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.304 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.589 HD12 HG21 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.71 -38.62 78.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.56 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 14.1 m-30 -64.73 -45.43 86.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.7 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.74 -38.04 89.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.886 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 25' ' ' TYR . 36.3 t -63.0 -50.71 78.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.016 0.436 . . . . 0.0 110.952 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.96 HD21 HD11 ' A' ' 62' ' ' ILE . 13.0 mt -62.71 -40.41 97.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.483 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -65.36 -40.55 93.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.456 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.4 tpt -62.21 -44.85 95.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.371 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.711 ' CD2' HD13 ' B' ' 101' ' ' LEU . 6.3 t80 -57.45 -45.09 85.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.017 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -74.59 -33.67 62.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -55.0 5.8 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.8 p -82.33 -19.8 38.63 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 3.7 mmt 63.36 26.82 15.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.883 0.373 . . . . 0.0 110.652 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -114.06 121.39 43.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.81 ' O ' HG23 ' A' ' 43' ' ' VAL . 22.0 t -78.38 -16.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.238 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.78 54.79 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.915 0.388 . . . . 0.0 110.825 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.53 -43.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.793 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.672 HD12 HD12 ' A' ' 46' ' ' LEU . 3.4 pp -69.01 -38.28 79.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.629 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 39' ' ' VAL . 79.5 t -61.56 -44.34 98.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.942 0.401 . . . . 0.0 110.377 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.31 -58.89 11.69 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.243 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.569 ' HA ' HD12 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -60.55 -39.32 87.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.819 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.771 ' HG ' HG11 ' A' ' 29' ' ' VAL . 12.0 mt -52.35 -45.02 65.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.738 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -57.36 -48.63 78.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.337 179.469 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.569 HD12 ' HA ' ' A' ' 45' ' ' ASP . 0.9 OUTLIER -51.07 -39.46 56.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.873 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 49' ' ' VAL . 10.9 p -100.94 4.93 10.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.42 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.871 HG23 ' O ' ' A' ' 55' ' ' ARG . 62.3 mt -138.34 27.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.257 0.551 . . . . 0.0 110.868 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 47' ' ' LYS . 22.5 m-20 -84.69 12.59 6.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.835 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -125.37 148.31 60.71 Favored Pre-proline 0 C--N 1.334 -0.083 0 C-N-CA 121.13 -0.228 . . . . 0.0 110.552 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.491 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.9 Cg_endo -51.79 -38.14 66.77 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.37 2.047 . . . . 0.0 111.466 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.6 p -69.54 -32.7 71.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.47 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.871 ' O ' HG23 ' A' ' 50' ' ' ILE . 86.2 mtt180 -90.57 -11.46 39.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.572 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.5 mt -55.97 -45.91 99.83 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.675 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.486 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 96.9 Cg_exo -44.32 -24.88 1.1 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.786 2.324 . . . . 0.0 113.532 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.806 ' CD2' HG22 ' A' ' 13' ' ' VAL . 6.9 mt -73.12 -35.35 66.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.747 0.308 . . . . 0.0 110.984 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HD1' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -59.06 -46.04 89.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 0.0 110.751 179.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.433 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.3 m-20 -75.04 -30.95 61.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.85 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.582 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -64.96 -63.39 1.12 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.984 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.96 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -59.03 -37.42 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.457 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 3.7 mtm180 -38.45 -66.39 0.31 Allowed Pre-proline 0 N--CA 1.468 0.444 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 79.3 Cg_exo -37.05 -30.69 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.214 2.609 . . . . 0.0 113.54 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.608 HD11 ' CE2' ' A' ' 9' ' ' PHE . 16.2 mt -65.18 -49.82 68.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.524 0.678 . . . . 0.0 109.651 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.537 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -53.07 138.42 46.12 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.744 179.409 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -48.34 165.46 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.691 2.26 . . . . 0.0 112.427 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.435 ' O ' HG23 ' A' ' 72' ' ' VAL . 3.6 tp -56.93 -57.11 13.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.967 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -57.13 -53.59 56.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.129 0.49 . . . . 0.0 110.251 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.537 ' CB ' HG23 ' A' ' 66' ' ' ILE . 24.1 m170 -59.21 -28.73 66.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.451 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.31 -42.23 93.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 68' ' ' LEU . 23.3 t -62.89 -42.78 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.497 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.519 ' HG2' HD11 ' A' ' 77' ' ' LEU . 25.6 tt0 -64.46 -45.68 86.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.341 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.645 ' CD2' HG22 ' A' ' 43' ' ' VAL . 8.5 t80 -59.77 -44.71 93.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.375 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.569 ' O ' ' HD3' ' A' ' 79' ' ' PRO . 0.1 OUTLIER -60.28 -46.61 89.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.824 179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -67.13 -21.85 65.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.661 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.519 HD11 ' HG2' ' A' ' 73' ' ' GLU . 13.8 mt -84.53 -29.65 25.76 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.56 ' OG1' ' HD3' ' A' ' 79' ' ' PRO . 0.2 OUTLIER -58.33 -49.35 94.06 Favored Pre-proline 0 N--CA 1.465 0.322 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.607 -178.762 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.569 ' HD3' ' O ' ' A' ' 75' ' ' ASP . 69.5 Cg_endo -94.35 -166.41 0.13 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.986 2.457 . . . . 0.0 112.697 -179.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.54 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 6.2 m -64.02 128.56 36.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.834 0.35 . . . . 0.0 110.972 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 88.7 mt -129.37 -44.19 1.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.999 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.711 HD13 ' CD2' ' A' ' 33' ' ' TYR . 2.6 pt? -51.81 -43.84 63.27 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.848 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.458 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 8.6 tttp -59.34 -33.91 71.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.382 179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -68.1 -36.45 79.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.56 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.025 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.9 t -68.37 -34.15 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.868 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -68.4 -45.55 72.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.423 179.451 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.32 -39.87 92.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -61.7 -40.15 94.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.648 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.437 ' CD2' ' HG3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.14 -47.07 47.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.75 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 9.8 mt -51.31 -40.07 58.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.874 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -76.73 -37.35 56.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.569 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.618 HD22 ' NH2' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -73.69 -6.1 44.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.721 179.197 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -94.28 -77.61 0.46 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.968 0.413 . . . . 0.0 110.955 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.864 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.517 ' HA ' HG23 ' A' ' 5' ' ' VAL . 40.1 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.875 0.369 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.781 ' O ' HD23 ' B' ' 100' ' ' LEU . 3.9 p-10 -126.17 -44.28 1.75 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.965 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -120.08 -37.6 3.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.998 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.4 -37.97 79.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.008 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.517 HG23 ' HA ' ' A' ' 1' ' ' MET . 24.8 t -58.07 -42.5 83.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.208 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.048 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -65.33 -50.95 63.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.995 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -26.79 69.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.315 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -70.12 -49.11 54.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.591 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.73 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -70.4 -42.67 71.35 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 179.012 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' HD3' ' CE2' ' B' ' 108' ' ' TYR . 6.8 tmm_? -58.44 -42.04 86.47 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.656 178.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.06 -46.15 88.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.453 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.412 ' HG2' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -60.38 -31.72 70.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.403 179.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.799 HG22 ' CD2' ' A' ' 58' ' ' LEU . 47.6 t -63.64 -48.05 88.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.36 179.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.62 -41.31 81.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.9 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -69.15 -35.23 76.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.315 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 35.2 mt -93.38 6.95 46.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.525 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.673 HG22 ' O ' ' A' ' 17' ' ' ILE . 39.1 mm -142.31 66.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-O 121.782 0.801 . . . . 0.0 109.98 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -51.43 -31.57 23.5 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.044 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.73 170.66 11.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.719 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.01 -30.13 9.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.95 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.96 -50.26 72.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.014 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.4 ' HB2' HG23 ' A' ' 17' ' ' ILE . 8.6 mt-10 -50.72 -34.59 27.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.36 0.6 . . . . 0.0 109.397 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 33.6 mttt -71.75 -35.59 70.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.935 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.49 -42.55 99.57 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.19 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.879 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -64.72 -44.6 89.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.403 179.491 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.676 HD12 HG21 ' A' ' 49' ' ' VAL . 0.5 OUTLIER -59.52 -36.51 76.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.711 179.637 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 12.8 m-30 -64.19 -48.52 75.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.617 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.32 -38.64 80.8 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.784 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.879 HG23 ' O ' ' A' ' 25' ' ' TYR . 11.5 t -60.86 -52.54 60.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.08 0.467 . . . . 0.0 110.793 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.702 HD21 HD11 ' A' ' 62' ' ' ILE . 28.5 mt -59.58 -42.97 93.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.317 179.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.98 -36.71 70.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.474 ' HA ' ' HG2' ' A' ' 35' ' ' GLN . 1.8 mmt -63.56 -48.37 77.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.105 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.623 ' HB3' HD21 ' B' ' 101' ' ' LEU . 0.1 OUTLIER -53.39 -39.44 64.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.0 179.634 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.443 ' HD2' HD23 ' B' ' 101' ' ' LEU . 1.0 OUTLIER -74.85 -46.13 38.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.84 -179.513 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.474 ' HG2' ' HA ' ' A' ' 32' ' ' MET . 7.4 pt20 -77.54 -52.68 8.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -178.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.4 p -92.78 -31.76 14.92 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.521 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 4.7 mmt 63.77 31.19 14.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.979 0.419 . . . . 0.0 110.79 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD2' ' HB3' ' A' ' 40' ' ' ALA . 2.2 t70 -104.87 118.51 36.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.917 ' O ' HG23 ' A' ' 43' ' ' VAL . 20.6 t -77.95 -14.61 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.463 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.455 ' HB3' ' OD2' ' A' ' 38' ' ' ASP . . . -76.07 -34.07 59.57 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 110.324 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.3 t -72.61 -37.76 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.203 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.541 ' O ' HD12 ' A' ' 46' ' ' LEU . 0.2 OUTLIER -65.24 -44.41 88.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.937 179.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.917 HG23 ' O ' ' A' ' 39' ' ' VAL . 56.5 t -54.56 -43.66 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-O 120.796 0.332 . . . . 0.0 111.2 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.38 -56.41 15.64 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.688 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.507 ' HB3' HG22 ' A' ' 29' ' ' VAL . 1.8 m-20 -59.43 -52.19 66.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.866 0.365 . . . . 0.0 111.1 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.663 HD23 ' CD1' ' A' ' 50' ' ' ILE . 0.7 OUTLIER -50.42 -45.01 55.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.073 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.47 ' O ' ' N ' ' A' ' 51' ' ' ASN . 6.0 mttp -57.62 -48.39 79.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.118 0.485 . . . . 0.0 110.704 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 45' ' ' ASP . 10.8 mt -54.1 -37.56 64.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.676 HG21 HD12 ' A' ' 26' ' ' LEU . 10.4 p -101.04 3.47 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.332 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.902 HG23 ' O ' ' A' ' 55' ' ' ARG . 61.4 mt -139.18 27.86 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 CA-C-O 121.305 0.574 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.47 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -88.6 16.86 6.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.72 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.414 ' CG ' ' HD2' ' A' ' 55' ' ' ARG . 18.9 mm-40 -128.94 142.87 46.59 Favored Pre-proline 0 C--N 1.335 -0.046 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.579 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 56' ' ' LEU . 87.1 Cg_exo -45.68 -39.16 17.88 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.254 1.97 . . . . 0.0 111.927 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -69.12 -34.84 75.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.719 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.902 ' O ' HG23 ' A' ' 50' ' ' ILE . 46.8 mtt85 -91.78 -9.71 42.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.91 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.491 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 10.5 mt -55.28 -46.12 99.74 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.651 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.47 -25.69 2.34 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.78 2.32 . . . . 0.0 113.523 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.799 ' CD2' HG22 ' A' ' 13' ' ' VAL . 3.4 mt -73.81 -34.15 64.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.85 0.357 . . . . 0.0 111.03 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.603 ' HE2' HG22 ' A' ' 78' ' ' THR . 0.2 OUTLIER -59.93 -50.86 72.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.436 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 5.0 t0 -75.2 -31.16 60.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.73 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -60.85 -53.67 54.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.903 -0.59 . . . . 0.0 112.052 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.702 HD11 HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -66.15 -36.78 78.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.906 0.384 . . . . 0.0 111.75 -179.571 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.402 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 0.0 OUTLIER -35.51 -61.24 0.54 Allowed Pre-proline 0 N--CA 1.469 0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.294 -179.234 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.436 ' CD ' ' O ' ' A' ' 60' ' ' ASP . 75.8 Cg_exo -34.75 -33.98 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.511 2.807 . . . . 0.0 113.467 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.503 HD11 HG21 ' B' ' 104' ' ' VAL . 15.1 mt -65.2 -53.97 36.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.596 0.712 . . . . 0.0 109.525 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -46.41 136.64 7.13 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.135 179.16 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -67.18 165.7 25.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.448 2.098 . . . . 0.0 112.028 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 72' ' ' VAL . 3.9 tp -51.13 -50.37 59.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.174 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -58.43 8.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.919 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.547 ' HB2' HG23 ' A' ' 66' ' ' ILE . 18.2 m170 -62.05 -25.79 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.397 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.28 -42.33 99.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.017 0.437 . . . . 0.0 110.047 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 68' ' ' LEU . 35.1 t -67.74 -44.74 85.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.424 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -67.22 -33.76 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.932 ' O ' HG23 ' A' ' 78' ' ' THR . 50.8 t80 -64.89 -39.29 93.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.328 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -67.87 -42.32 81.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.797 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -66.76 -27.32 67.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.349 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.3 mt -86.61 -25.86 24.71 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.932 HG23 ' O ' ' A' ' 74' ' ' TYR . 71.7 p -55.51 -45.11 99.92 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.654 ' HD2' ' N ' ' A' ' 78' ' ' THR . 18.5 Cg_endo -58.62 164.19 9.75 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 121.979 1.786 . . . . 0.0 112.325 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.94 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 19.3 m -91.16 -26.33 19.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.768 0.318 . . . . 0.0 110.958 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.781 HD23 ' O ' ' A' ' 2' ' ' ASP . 0.7 OUTLIER -55.28 -29.84 58.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.05 -179.885 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.623 HD21 ' HB3' ' A' ' 33' ' ' TYR . 3.3 tp -56.18 -52.62 63.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.986 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.479 ' HA ' HD21 ' B' ' 105' ' ' LEU . 18.2 tttp -63.07 -31.56 72.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.24 -44.66 91.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.323 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.048 HG22 ' HB1' ' A' ' 6' ' ' ALA . 24.7 t -66.08 -54.2 29.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.227 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.674 HD12 ' N ' ' B' ' 106' ' ' GLU . 4.4 pp -61.75 -32.88 73.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . 0.674 ' N ' HD12 ' B' ' 105' ' ' LEU . 46.3 tt0 -73.96 -40.35 63.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.717 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -61.36 -35.64 78.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.443 ' CE2' ' HD3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -74.23 -51.09 16.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.2 0.524 . . . . 0.0 110.492 179.632 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' B' ' 109' ' ' LEU . 32.7 mt -51.16 -37.5 46.72 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.459 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' B' ' 111' ' ' LEU . 2.1 ptp180 -76.98 -35.69 56.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.197 179.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.419 ' N ' ' HG3' ' B' ' 110' ' ' ARG . 0.1 OUTLIER -64.06 -16.96 62.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.063 178.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 10.5 mmmt -100.26 -39.72 7.89 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.838 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.822 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.823 0.344 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -100.22 137.41 38.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.967 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.66 -35.11 7.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.78 -34.24 71.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.765 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -66.44 -35.1 74.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.75 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.99 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -70.01 -50.26 43.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.975 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -26.78 68.58 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.249 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.53 -49.11 51.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.389 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.66 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -69.55 -43.99 71.82 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.058 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.668 HH21 HG11 ' A' ' 13' ' ' VAL . 5.1 tpm_? -59.07 -40.82 86.38 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.581 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -59.33 -42.49 91.58 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.831 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 15.6 mttp -60.39 -37.23 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.272 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.795 HG13 HD22 ' A' ' 58' ' ' LEU . 41.9 t -59.9 -48.93 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.543 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -57.62 -39.07 76.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.219 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -69.05 -32.45 71.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.481 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.0 mt -100.42 8.53 43.54 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.529 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.693 HG22 ' O ' ' A' ' 17' ' ' ILE . 35.3 mm -147.02 68.52 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.702 0.763 . . . . 0.0 110.051 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -58.78 -33.37 70.24 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.891 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -72.72 139.15 47.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.742 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -75.46 -28.87 59.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.033 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -52.65 64.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.032 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.604 ' HB2' HG23 ' A' ' 17' ' ' ILE . 25.7 mt-10 -50.98 -34.76 30.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 17.7 mttp -72.21 -34.25 68.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.887 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -61.61 -41.8 97.98 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.188 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.906 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -67.76 -42.08 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.291 179.426 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.5 mt -63.1 -39.01 93.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.532 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.401 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.7 m-85 -62.67 -44.48 96.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.63 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -63.5 -44.51 94.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.547 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 25' ' ' TYR . 21.6 t -59.46 -46.49 92.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.07 HD21 HD11 ' A' ' 62' ' ' ILE . 3.8 mt -59.7 -44.41 93.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.426 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.86 -36.24 72.07 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.508 179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.428 ' O ' ' N ' ' A' ' 36' ' ' THR . 25.8 mtp -63.35 -48.94 75.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.139 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.454 ' CE2' HG13 ' A' ' 66' ' ' ILE . 0.1 OUTLIER -53.54 -42.55 67.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.878 0.37 . . . . 0.0 110.883 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -44.55 49.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.869 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -77.34 -55.01 5.76 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.428 ' N ' ' O ' ' A' ' 32' ' ' MET . 0.9 OUTLIER -92.2 -43.39 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -178.666 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.442 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 2.5 ttt 74.51 32.98 0.88 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.853 0.359 . . . . 0.0 110.652 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.707 ' O ' HD12 ' A' ' 42' ' ' LEU . 9.9 p30 -98.14 115.92 29.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.555 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.895 ' O ' HG23 ' A' ' 43' ' ' VAL . 20.8 t -79.2 -16.63 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.447 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.88 -37.68 47.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.017 0.437 . . . . 0.0 110.478 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.533 HG21 ' OD2' ' A' ' 38' ' ' ASP . 25.4 t -73.56 -34.06 40.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.279 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.707 HD12 ' O ' ' A' ' 38' ' ' ASP . 0.2 OUTLIER -69.51 -41.37 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.803 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 39' ' ' VAL . 95.0 t -60.0 -40.06 82.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.639 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.17 -57.27 12.11 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.449 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.55 -48.66 76.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.871 0.367 . . . . 0.0 110.908 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.56 ' HG ' HG11 ' A' ' 29' ' ' VAL . 65.6 mt -50.52 -41.93 54.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.874 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.1 OUTLIER -62.15 -44.94 95.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.105 0.478 . . . . 0.0 110.435 179.621 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.1 mt -54.95 -37.05 65.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.76 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.693 HG13 HG13 ' A' ' 50' ' ' ILE . 15.0 p -101.12 -0.78 10.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.394 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.882 HG23 ' O ' ' A' ' 55' ' ' ARG . 49.0 mt -136.64 29.46 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.083 0.468 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 17.8 p30 -89.31 16.53 7.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.674 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -131.01 143.7 50.52 Favored Pre-proline 0 C--N 1.333 -0.112 0 CA-C-O 120.561 0.22 . . . . 0.0 110.435 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.521 ' HA ' HD12 ' A' ' 56' ' ' LEU . 86.7 Cg_exo -46.25 -39.49 21.19 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.343 2.029 . . . . 0.0 111.974 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 m -69.21 -33.55 73.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.624 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.882 ' O ' HG23 ' A' ' 50' ' ' ILE . 11.2 mtp180 -89.87 -12.04 40.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.477 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 53' ' ' PRO . 14.8 mt -53.78 -46.07 98.56 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 94.1 Cg_exo -43.72 -27.21 1.44 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.706 2.271 . . . . 0.0 113.736 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.795 HD22 HG13 ' A' ' 13' ' ' VAL . 14.9 mt -73.72 -34.23 64.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.783 0.325 . . . . 0.0 111.139 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.72 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -65.96 -45.84 80.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 110.888 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.32 -31.48 60.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.832 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.536 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.35 -63.06 1.35 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.732 -179.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 1.07 HD11 HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.71 -30.86 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.971 0.415 . . . . 0.0 111.648 -179.619 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.498 ' HB3' ' CD ' ' A' ' 64' ' ' PRO . 25.1 ttp180 -40.18 -60.26 1.54 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.498 ' CD ' ' HB3' ' A' ' 63' ' ' ARG . 6.7 Cg_endo -48.76 -25.64 8.5 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.69 2.26 . . . . 0.0 113.28 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.66 HD11 ' CE2' ' A' ' 9' ' ' PHE . 26.1 mt -65.57 -45.25 84.02 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.568 0.699 . . . . 0.0 109.575 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.637 HG23 ' HB2' ' A' ' 70' ' ' HIS . 1.3 mp -50.7 136.43 25.65 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 114.625 -1.17 . . . . 0.0 111.149 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -61.39 165.78 12.47 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.576 2.184 . . . . 0.0 112.188 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.511 ' O ' HG23 ' A' ' 72' ' ' VAL . 16.8 mt -52.01 -49.76 62.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.467 -179.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -56.75 -61.35 2.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.162 0.506 . . . . 0.0 110.681 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.637 ' HB2' HG23 ' A' ' 66' ' ' ILE . 16.0 m170 -60.23 -26.66 66.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -60.81 -46.95 88.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.041 0.448 . . . . 0.0 109.896 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 68' ' ' LEU . 20.0 t -62.23 -45.0 99.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.935 179.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -66.12 -31.35 72.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.32 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.718 ' O ' HG23 ' A' ' 78' ' ' THR . 4.2 t80 -63.06 -46.34 87.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.67 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.18 -42.07 96.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.672 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.416 HE21 HG12 ' A' ' 72' ' ' VAL . 76.4 mt-30 -59.92 -35.38 74.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.726 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.555 HD13 HG21 ' A' ' 43' ' ' VAL . 6.4 mt -85.7 -32.79 21.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.01 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.718 HG23 ' O ' ' A' ' 74' ' ' TYR . 36.9 p -89.63 112.07 49.64 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.964 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.94 120.44 7.91 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.465 2.11 . . . . 0.0 112.189 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.857 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.24 -174.02 2.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.656 0.265 . . . . 0.0 110.914 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.411 HD22 ' CD2' ' A' ' 65' ' ' LEU . 2.7 mt 68.7 -61.06 0.42 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.253 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 26.3 tp -53.35 -52.75 58.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.959 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -56.68 -31.66 64.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.961 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -67.63 -38.41 83.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.977 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.99 HG22 ' HB1' ' A' ' 6' ' ' ALA . 23.9 t -70.85 -34.93 57.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.482 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.552 ' O ' HD12 ' B' ' 109' ' ' LEU . 0.5 OUTLIER -67.26 -45.62 76.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.425 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -73.61 -33.71 64.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.726 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -58.7 -50.09 75.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.794 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -44.47 46.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.693 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.582 HD23 ' HE2' ' B' ' 112' ' ' LYS . 4.9 mt -51.43 -41.68 60.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.57 -40.8 41.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.009 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.23 -20.06 38.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.567 179.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . 0.582 ' HE2' HD23 ' B' ' 109' ' ' LEU . 0.0 OUTLIER -101.16 -23.37 14.46 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.204 179.629 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . 0.414 ' N ' ' HD2' ' B' ' 112' ' ' LYS . 10.9 mttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.19 -0.909 . . . . 0.0 110.915 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 ttm . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.793 0.33 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -110.07 31.26 6.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.932 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.7 -30.71 26.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.907 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -59.28 -33.52 71.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.9 t -61.61 -39.19 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.0 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.52 -50.96 56.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.183 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -66.68 -26.88 67.25 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.069 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -71.63 -48.93 44.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.372 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.918 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.32 -44.04 72.5 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.016 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.492 ' CZ ' HD22 ' B' ' 111' ' ' LEU . 0.0 OUTLIER -59.47 -41.13 89.02 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.838 178.673 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -58.46 -43.0 88.69 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.8 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -60.7 -35.47 76.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.161 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 1.056 HG13 HD21 ' A' ' 58' ' ' LEU . 54.8 t -60.71 -48.46 88.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.465 179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -57.62 -41.33 81.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.191 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -69.14 -32.61 72.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.472 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.7 mt -97.99 7.47 46.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.547 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.658 HG22 ' O ' ' A' ' 17' ' ' ILE . 35.6 mm -146.59 68.63 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.931 0 CA-C-O 121.671 0.748 . . . . 0.0 109.861 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -55.92 -33.48 64.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.871 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -71.25 159.63 34.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.695 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.0 -29.78 15.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.975 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.54 -52.67 64.55 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.035 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.551 ' HB2' HG23 ' A' ' 17' ' ' ILE . 12.5 mt-10 -50.8 -34.77 28.93 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -72.88 -34.17 66.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.944 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -64.88 -44.67 88.92 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.249 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.883 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -64.8 -40.18 94.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.249 179.371 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.603 HD11 HD22 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -64.12 -39.73 94.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.492 179.595 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -60.89 -43.57 98.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.481 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -64.81 -36.29 83.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.547 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 25' ' ' TYR . 28.0 t -65.62 -45.41 92.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.019 HD21 HD11 ' A' ' 62' ' ' ILE . 12.9 mt -65.52 -43.3 90.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.522 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -63.63 -31.11 72.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.42 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -52.1 35.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.378 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.565 ' CG ' HD12 ' A' ' 42' ' ' LEU . 14.8 t80 -57.55 -33.88 68.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.996 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -74.57 -41.6 60.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.994 0.426 . . . . 0.0 111.018 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -77.45 -54.99 5.76 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.38 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 p -81.67 -28.79 33.37 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.518 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.0 mmt 64.13 35.46 10.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 110.607 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -118.21 124.23 47.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.837 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.883 ' O ' HG23 ' A' ' 43' ' ' VAL . 4.7 t -77.63 -7.37 10.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.377 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -38.56 47.99 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.05 0.453 . . . . 0.0 110.269 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.25 -33.98 60.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.99 179.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.89 HD22 HD11 ' A' ' 46' ' ' LEU . 1.2 mt -66.82 -49.77 64.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.884 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 39' ' ' VAL . 29.0 t -58.68 -42.87 86.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.477 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.35 -58.29 14.1 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.848 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -66.13 -40.9 91.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.258 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.89 HD11 HD22 ' A' ' 42' ' ' LEU . 20.7 mt -51.51 -47.44 63.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.096 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.48 ' O ' ' N ' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -55.76 -46.84 77.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 0.0 110.702 179.685 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.6 mt -53.57 -41.18 66.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.841 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.634 HG13 HG13 ' A' ' 50' ' ' ILE . 14.3 p -101.19 8.44 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.354 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.862 HG23 ' O ' ' A' ' 55' ' ' ARG . 71.2 mt -144.88 28.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.236 0.541 . . . . 0.0 111.094 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 47' ' ' LYS . 14.5 p30 -90.18 15.32 10.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.559 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -128.79 150.86 76.13 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.07 -39.21 70.75 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.38 2.053 . . . . 0.0 111.558 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.6 p -69.58 -34.01 73.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.806 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.862 ' O ' HG23 ' A' ' 50' ' ' ILE . 45.6 mtt180 -90.22 -12.21 38.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.69 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.485 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 11.7 mt -53.03 -46.33 97.7 Favored Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 83.4 Cg_exo -46.65 -24.92 3.17 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.806 2.337 . . . . 0.0 113.56 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.056 HD21 HG13 ' A' ' 13' ' ' VAL . 27.8 mt -67.23 -35.3 79.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.709 0.29 . . . . 0.0 111.189 -179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.37 -45.01 95.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.519 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.43 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 1.3 t0 -75.2 -31.12 60.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.848 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.918 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -63.25 -54.69 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.093 -179.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 1.019 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -71.19 -38.1 69.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.581 ' HB3' ' HD3' ' A' ' 64' ' ' PRO . 2.0 tmm_? -36.94 -55.76 1.55 Allowed Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.581 ' HD3' ' HB3' ' A' ' 63' ' ' ARG . 81.5 Cg_exo -41.16 -34.23 1.55 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.766 2.31 . . . . 0.0 112.958 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.596 HD12 HG13 ' A' ' 62' ' ' ILE . 24.3 mt -65.31 -51.28 61.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.391 0.615 . . . . 0.0 110.338 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.497 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -44.78 134.75 4.84 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.186 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -53.17 165.55 1.33 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.636 2.224 . . . . 0.0 112.361 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 13.7 tp -55.8 -55.51 31.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.952 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.07 -53.61 56.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.034 0.445 . . . . 0.0 110.403 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.497 ' CB ' HG23 ' A' ' 66' ' ' ILE . 19.2 m170 -59.62 -31.02 69.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.324 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.24 -45.64 92.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.3 179.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 32.6 t -61.53 -47.76 91.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.096 179.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.09 -29.19 69.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.199 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.62 ' OH ' HD13 ' A' ' 46' ' ' LEU . 16.7 t80 -60.87 -52.02 66.81 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.651 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -62.47 -43.22 99.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.602 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -59.59 -29.72 68.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.884 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.5 mt -85.65 -37.7 19.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.855 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.56 HG22 ' O ' ' A' ' 74' ' ' TYR . 1.3 t -127.62 109.67 20.74 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.811 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.05 137.16 17.06 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.508 2.138 . . . . 0.0 112.575 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.0 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.466 -0.254 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 21.4 m -72.77 64.89 0.68 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 110.859 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mt -77.07 -51.11 11.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.865 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.813 HD11 HD23 ' A' ' 30' ' ' LEU . 11.7 tp -54.43 -52.85 60.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.827 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' B' ' 105' ' ' LEU . 0.2 OUTLIER -57.75 -31.63 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.036 179.745 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.55 -41.02 93.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.145 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.0 HG22 ' HB1' ' A' ' 6' ' ' ALA . 25.8 t -70.47 -36.12 64.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.505 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.516 HD22 ' HB3' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -62.57 -45.65 91.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.91 0.386 . . . . 0.0 110.214 179.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -33.82 71.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.752 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -58.54 -43.45 89.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.879 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.45 ' CE2' ' HG2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.04 -49.69 27.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.764 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 19.2 mt -51.14 -38.32 51.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.721 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 7.0 mtm-85 -76.91 -36.95 56.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.431 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.492 HD22 ' CZ ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -65.27 -14.83 61.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.319 178.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -93.07 -48.97 6.24 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.986 0.422 . . . . 0.0 110.855 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 5.8 mtmt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.865 -179.979 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 120.849 0.357 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.428 ' O ' ' CB ' ' A' ' 3' ' ' ARG . 16.8 p30 -164.2 148.78 9.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.819 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.428 ' CB ' ' O ' ' A' ' 2' ' ' ASP . 0.3 OUTLIER 82.41 -42.89 0.13 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.541 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -59.05 -45.15 91.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.833 0.349 . . . . 0.0 111.029 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -58.98 -40.77 81.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.866 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.109 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.53 -49.03 58.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.878 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -66.11 -26.76 67.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.111 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -71.06 -49.12 48.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.375 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.724 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -69.25 -44.39 72.04 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.083 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.45 85.16 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 20.0 t-160 -57.63 -42.43 83.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.561 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.6 mtpp -59.98 -36.78 77.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.911 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.998 HG22 HD22 ' A' ' 58' ' ' LEU . 48.8 t -58.56 -49.73 81.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.219 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -57.68 -38.25 74.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.215 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -68.93 -39.14 79.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.469 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.466 ' O ' HD13 ' A' ' 17' ' ' ILE . 16.3 mt -93.02 7.44 44.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.434 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.644 HG22 ' O ' ' A' ' 17' ' ' ILE . 42.4 mm -148.11 68.61 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.621 0.724 . . . . 0.0 110.141 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.85 -35.65 69.09 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.951 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -64.97 174.36 1.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -107.49 -33.29 7.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.935 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -51.48 69.24 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.986 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.411 ' HB2' HG23 ' A' ' 17' ' ' ILE . 19.6 mt-10 -50.8 -34.82 29.14 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.448 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 4.8 mttm -71.8 -34.61 69.52 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.97 178.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.45 -44.47 96.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.169 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.829 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -64.94 -41.71 95.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.357 179.429 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.58 -42.76 93.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.739 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.495 ' CE1' ' CG ' ' B' ' 108' ' ' TYR . 15.8 m-85 -61.46 -44.44 97.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.521 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.42 -32.92 72.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.846 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.966 HG12 HD23 ' A' ' 42' ' ' LEU . 21.5 t -66.07 -51.83 55.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.905 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.045 HD21 HD11 ' A' ' 62' ' ' ILE . 32.2 mt -62.05 -36.2 80.91 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.47 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.5 ttp180 -62.35 -38.81 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.385 179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.437 ' O ' HG23 ' A' ' 36' ' ' THR . 10.3 mmm -65.19 -48.04 74.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.54 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.487 ' CD1' HD12 ' A' ' 42' ' ' LEU . 11.0 t80 -57.35 -33.67 68.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -70.1 -52.61 22.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.219 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -77.46 -54.96 5.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.918 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 32' ' ' MET . 5.5 p -66.87 -38.72 86.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.893 -179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.423 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 5.1 mmt 64.67 28.87 13.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.84 0.352 . . . . 0.0 110.716 -179.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.16 127.13 53.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.866 ' O ' HG23 ' A' ' 43' ' ' VAL . 21.8 t -75.26 -7.55 10.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.168 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.9 -36.47 56.64 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.008 0.432 . . . . 0.0 110.199 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 37.5 t -70.82 -33.97 54.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.966 HD23 HG12 ' A' ' 29' ' ' VAL . 2.3 mt -67.27 -47.77 69.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.833 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 39' ' ' VAL . 31.3 t -57.72 -45.65 86.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.555 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.84 -57.39 17.71 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.049 -179.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.801 ' HB3' HG22 ' A' ' 29' ' ' VAL . 9.0 m-20 -64.88 -42.93 94.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.705 0.288 . . . . 0.0 111.28 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.715 HD11 HD22 ' A' ' 42' ' ' LEU . 26.9 mt -50.42 -53.29 30.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.5 mttt -53.18 -48.36 68.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.873 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.9 mt -49.96 -42.95 49.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.083 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.9 p -101.09 5.72 10.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.427 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.861 HG23 ' O ' ' A' ' 55' ' ' ARG . 41.6 mt -138.19 28.39 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.329 0.585 . . . . 0.0 110.941 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 47' ' ' LYS . 12.6 m-20 -84.84 13.68 5.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.907 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -126.31 143.03 44.55 Favored Pre-proline 0 N--CA 1.457 -0.085 0 C-N-CA 121.089 -0.244 . . . . 0.0 110.633 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 56' ' ' LEU . 83.2 Cg_exo -46.86 -38.92 23.93 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.281 1.987 . . . . 0.0 111.801 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.4 t -69.3 -32.82 72.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.582 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.861 ' O ' HG23 ' A' ' 50' ' ' ILE . 91.5 mtt180 -90.12 -12.69 37.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.547 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.495 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 13.5 mt -54.42 -45.98 99.2 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.495 ' CD ' ' N ' ' A' ' 56' ' ' LEU . 98.7 Cg_exo -44.2 -30.9 3.78 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.788 2.325 . . . . 0.0 113.69 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.998 HD22 HG22 ' A' ' 13' ' ' VAL . 16.7 mt -64.6 -39.86 94.47 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.686 0.279 . . . . 0.0 111.272 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.467 ' HE1' HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -54.5 -47.26 73.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.006 0.432 . . . . 0.0 110.627 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -75.31 -31.26 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.715 179.475 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.724 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -61.81 -57.02 13.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.907 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 1.045 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -63.52 -37.41 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 112.043 -179.177 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.442 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.3 mtp85 -36.44 -64.58 0.36 Allowed Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 63' ' ' ARG . 73.7 Cg_exo -36.49 -33.85 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.234 2.623 . . . . 0.0 113.221 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.676 HD12 HG13 ' A' ' 62' ' ' ILE . 24.4 mt -65.13 -51.28 62.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.447 0.641 . . . . 0.0 110.117 179.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.506 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -45.37 135.32 5.62 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.304 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -51.16 165.67 0.5 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.667 2.244 . . . . 0.0 112.336 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.4 mt -56.03 -57.06 13.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.117 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.466 ' O ' HG12 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -59.68 -46.58 88.63 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.706 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.506 ' CB ' HG23 ' A' ' 66' ' ' ILE . 23.2 m170 -65.37 -25.48 67.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.476 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.46 -55.03 35.71 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.569 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 69' ' ' LYS . 7.5 p -62.83 -37.59 79.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.385 179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.523 ' OE2' HD11 ' A' ' 77' ' ' LEU . 0.5 OUTLIER -70.2 -31.69 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.362 179.318 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.804 ' O ' HG22 ' A' ' 78' ' ' THR . 11.4 t80 -64.08 -47.82 78.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.477 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -62.95 -43.11 99.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.586 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -59.92 -33.5 71.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.683 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.523 HD11 ' OE2' ' A' ' 73' ' ' GLU . 28.4 mt -73.67 -35.45 65.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.901 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.804 HG22 ' O ' ' A' ' 74' ' ' TYR . 0.5 OUTLIER -106.99 103.47 47.83 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 179.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -80.95 -168.25 0.61 Allowed 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.744 2.296 . . . . 0.0 112.352 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.8 mmm-85 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.849 179.825 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 77.3 p -156.0 -45.89 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.905 0.383 . . . . 0.0 110.999 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp -88.5 -35.24 17.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.88 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.661 HD12 HD13 ' A' ' 65' ' ' LEU . 21.9 tp -53.99 -52.59 60.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.797 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -31.7 67.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.704 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.32 -38.81 91.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.883 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.109 HG22 ' HB1' ' A' ' 6' ' ' ALA . 22.1 t -69.66 -41.54 80.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.059 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.2 mt -57.61 -44.17 85.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.29 0.567 . . . . 0.0 109.909 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -73.66 -32.81 64.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.955 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' B' ' 110' ' ' ARG . 18.1 m-20 -57.3 -50.4 73.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.929 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' B' ' 105' ' ' LEU . 4.2 p90 -79.99 -33.92 38.98 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.244 -0.583 . . . . 0.0 109.997 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.471 ' HG ' ' CE1' ' B' ' 108' ' ' TYR . 12.6 mt -60.54 -36.64 78.92 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' B' ' 107' ' ' ASP . 0.2 OUTLIER -77.21 -36.27 54.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.275 179.381 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' B' ' 111' ' ' LEU . 9.0 mt -76.69 -6.27 51.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.402 178.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . 0.448 ' HE3' ' CD2' ' A' ' 27' ' ' TYR . 0.1 OUTLIER -74.73 -78.41 0.1 Allowed 'General case' 0 N--CA 1.458 -0.069 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.852 -179.939 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.224 -0.894 . . . . 0.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.852 0.358 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.83 72.43 10.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.942 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -178.42 -38.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.95 -42.79 99.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.813 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.21 -35.07 59.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.077 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -69.94 -51.05 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.004 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.28 -26.88 67.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.198 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.74 -45.97 60.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.456 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -70.7 -44.76 66.3 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.981 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.67 -42.77 89.25 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.781 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -60.15 -40.28 89.31 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.937 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -62.28 -36.27 81.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.06 179.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.711 HG22 HD22 ' A' ' 58' ' ' LEU . 47.2 t -59.41 -52.06 65.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.228 179.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -57.47 -35.22 69.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.167 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -69.01 -39.8 79.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.599 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 mt -98.12 11.17 38.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.557 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.66 HG22 ' O ' ' A' ' 17' ' ' ILE . 36.0 mm -149.44 69.12 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-O 121.692 0.758 . . . . 0.0 110.143 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -60.42 -36.77 78.95 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.739 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -62.08 140.28 58.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.704 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.88 -36.61 56.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.36 65.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.852 0.358 . . . . 0.0 111.16 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.537 ' HB2' HG23 ' A' ' 17' ' ' ILE . 47.3 mt-10 -50.68 -34.75 27.85 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.417 ' O ' ' CD2' ' A' ' 27' ' ' TYR . 9.9 mtpt -73.26 -35.34 66.2 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.847 178.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.09 -39.22 94.08 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.007 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.884 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -68.0 -43.41 78.94 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.311 179.366 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -62.87 -45.46 92.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.677 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' O ' ' A' ' 23' ' ' LYS . 21.4 m-85 -60.93 -37.06 80.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.675 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.78 -32.99 73.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.592 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 25' ' ' TYR . 21.5 t -72.0 -39.45 66.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.837 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.665 HD21 HD11 ' A' ' 62' ' ' ILE . 16.5 mt -69.89 -40.71 75.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.535 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.97 -37.27 81.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.333 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.32 -46.03 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.13 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.735 ' CG ' HD22 ' A' ' 42' ' ' LEU . 6.4 t80 -60.15 -35.66 75.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.437 ' CE1' ' HE3' ' B' ' 102' ' ' LYS . 42.2 t-80 -74.58 -44.67 49.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.326 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -77.51 -54.98 5.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.162 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.3 p -74.17 -23.09 59.18 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 18.7 mmt 61.24 22.25 12.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.676 0.274 . . . . 0.0 110.798 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.616 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -98.47 116.45 30.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.707 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.752 ' HA ' HD23 ' A' ' 42' ' ' LEU . 21.6 t -80.15 -21.41 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.187 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.2 -32.46 56.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.7 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.616 HG23 ' HB3' ' A' ' 38' ' ' ASP . 39.2 t -73.4 -42.32 56.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.801 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 39' ' ' VAL . 0.4 OUTLIER -69.11 -36.15 77.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.701 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 39' ' ' VAL . 54.1 t -66.81 -43.16 89.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.023 0.44 . . . . 0.0 110.338 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.39 -56.05 27.23 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.334 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -60.99 -42.26 98.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.94 0.4 . . . . 0.0 110.719 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.804 HD22 ' CD1' ' A' ' 50' ' ' ILE . 12.2 mt -50.44 -43.74 55.18 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.743 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 51' ' ' ASN . 16.3 mmtt -56.69 -50.59 71.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.245 0.545 . . . . 0.0 110.58 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -38.5 54.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.912 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 49' ' ' VAL . 12.5 p -101.15 5.49 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.416 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.856 HG23 ' O ' ' A' ' 55' ' ' ARG . 69.2 mt -141.31 29.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.272 0.558 . . . . 0.0 110.826 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 47' ' ' LYS . 16.5 m-20 -82.11 9.06 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.413 ' CG ' ' CD ' ' A' ' 55' ' ' ARG . 2.8 pt-20 -132.61 153.93 81.31 Favored Pre-proline 0 N--CA 1.462 0.157 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.367 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.482 ' HA ' HD12 ' A' ' 56' ' ' LEU . 9.8 Cg_endo -51.23 -38.25 61.05 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.836 2.357 . . . . 0.0 112.168 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -32.47 72.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.411 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.856 ' O ' HG23 ' A' ' 50' ' ' ILE . 14.8 mtp180 -94.47 -10.24 32.96 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.441 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.595 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 13.4 mt -54.13 -54.2 50.14 Favored Pre-proline 0 C--N 1.332 -0.161 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.595 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 2.6 Cg_endo -41.44 -24.89 0.25 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.123 2.549 . . . . 0.0 113.841 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.711 HD22 HG22 ' A' ' 13' ' ' VAL . 17.6 mt -73.74 -31.49 63.38 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.312 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.785 ' HB2' HG21 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -72.36 -41.29 66.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 110.963 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.444 ' O ' ' CD ' ' A' ' 64' ' ' PRO . 3.3 m-20 -75.03 -30.92 61.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.654 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.826 ' HB1' ' HB2' ' A' ' 9' ' ' PHE . . . -68.81 -60.08 2.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.009 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.665 HD11 HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.06 -35.84 59.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.929 -179.452 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.436 ' CB ' ' CD ' ' A' ' 64' ' ' PRO . 4.2 ttt-85 -41.82 -65.64 0.49 Allowed Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.126 -179.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.464 ' HD2' ' O ' ' A' ' 61' ' ' ALA . 81.1 Cg_exo -35.57 -30.75 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.337 2.691 . . . . 0.0 113.757 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.849 HD11 ' CE2' ' A' ' 9' ' ' PHE . 25.0 mt -64.94 -50.78 65.07 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.468 0.652 . . . . 0.0 109.784 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.564 HG23 ' CB ' ' A' ' 70' ' ' HIS . 1.6 mp -41.59 127.94 2.37 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.452 179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.454 ' HD2' ' OH ' ' A' ' 33' ' ' TYR . 52.9 Cg_exo -55.21 165.8 2.75 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.66 2.24 . . . . 0.0 112.175 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.502 ' O ' HG23 ' A' ' 72' ' ' VAL . 1.5 mp -52.19 -50.18 62.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.287 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -57.74 -60.6 3.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.168 0.509 . . . . 0.0 110.39 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.564 ' CB ' HG23 ' A' ' 66' ' ' ILE . 44.7 m170 -58.76 -24.23 61.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.378 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -44.43 83.36 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.087 0.47 . . . . 0.0 109.82 179.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 68' ' ' LEU . 28.6 t -61.58 -42.96 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.736 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.87 -31.74 70.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.147 178.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.539 ' O ' HG22 ' A' ' 78' ' ' THR . 4.3 t80 -59.04 -48.62 80.94 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.546 179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -68.0 -38.56 82.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.751 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -57.23 -35.34 69.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.804 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 mt -84.38 -31.2 24.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.771 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 74' ' ' TYR . 1.4 t -137.1 113.12 9.61 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.754 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.41 166.24 26.22 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.46 2.107 . . . . 0.0 112.318 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.883 -179.955 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.542 -0.223 . . . . 0.0 112.542 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -107.9 83.87 1.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 110.965 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.508 ' O ' HG23 ' B' ' 104' ' ' VAL . 3.4 mt -107.99 -31.01 8.15 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.827 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.683 ' HA ' HD13 ' A' ' 65' ' ' LEU . 2.1 pt? -52.24 -41.84 63.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.813 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.511 ' N ' ' HG ' ' B' ' 101' ' ' LEU . 20.9 tttt -60.32 -38.84 84.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -34.41 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.722 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 1.077 HG22 ' HB1' ' A' ' 6' ' ' ALA . 2.8 t -70.97 -34.79 56.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.496 ' N ' HD23 ' B' ' 105' ' ' LEU . 0.7 OUTLIER -66.67 -45.62 78.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.961 0.41 . . . . 0.0 110.065 179.195 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -69.87 -34.33 73.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.642 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.41 -48.25 81.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.23 -42.74 79.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.57 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 10.2 mt -51.18 -39.22 55.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.547 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 74.3 mtp180 -76.82 -34.96 57.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.09 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.0 -16.77 62.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.187 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -73.21 -73.94 0.19 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.816 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 4.9 mttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.895 179.96 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 mtt . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.779 0.324 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -177.01 57.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.74 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 53.0 mtm-85 -115.91 -34.44 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.157 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -59.3 -36.54 75.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.96 -39.78 78.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.212 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HB1' HG22 ' B' ' 104' ' ' VAL . . . -67.27 -51.18 56.09 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.085 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.69 ' HD2' HD11 ' B' ' 111' ' ' LEU . 3.3 ttp-105 -65.77 -26.79 67.88 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.303 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -72.6 -48.74 37.24 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.47 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.808 ' CD1' ' HB1' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -68.86 -42.51 76.96 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.142 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.625 HH21 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -61.26 -42.77 99.19 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.893 178.749 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 18.8 t-160 -56.85 -41.44 77.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.176 0.512 . . . . 0.0 109.674 178.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -60.48 -38.05 83.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.018 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 1.012 HG13 HD21 ' A' ' 58' ' ' LEU . 57.5 t -57.68 -50.06 78.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.469 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -57.72 -37.81 74.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.105 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.593 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.6 mt -97.43 8.83 43.86 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.528 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.634 HG22 ' O ' ' A' ' 17' ' ' ILE . 37.3 mm -148.96 69.13 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 CA-C-O 121.619 0.723 . . . . 0.0 110.092 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -33.46 69.6 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.921 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.71 175.58 1.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.965 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -110.25 -29.76 8.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.959 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.53 -52.82 61.95 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.419 ' O ' HD12 ' A' ' 26' ' ' LEU . 6.4 mt-10 -50.84 -34.88 29.69 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 11.2 mttt -72.95 -34.14 66.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.86 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -62.38 -42.65 99.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.041 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.79 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -66.93 -40.93 87.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.281 179.422 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 22' ' ' GLU . 1.9 mt -61.46 -38.22 86.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.642 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 19.9 m-85 -65.48 -43.97 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.3 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.756 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 25' ' ' TYR . 17.0 t -65.1 -50.18 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.905 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.069 HD21 HD11 ' A' ' 62' ' ' ILE . 5.9 mt -63.83 -33.5 75.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.426 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -67.02 -41.6 86.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.66 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.83 -43.55 92.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.411 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 37' ' ' MET . 1.7 t80 -60.79 -38.41 85.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.841 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -74.88 -46.79 33.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.869 0.366 . . . . 0.0 111.323 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -54.74 6.0 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.2 -34.71 12.13 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.496 ' HA ' ' O ' ' A' ' 33' ' ' TYR . 3.1 mtt 72.74 32.03 1.53 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.808 0.337 . . . . 0.0 110.793 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.474 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.4 OUTLIER -84.37 115.1 22.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.395 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.709 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.9 t -77.76 -23.71 14.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.8 -37.15 30.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 38' ' ' ASP . 24.8 t -73.55 -35.86 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.664 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.789 ' HA ' HG13 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -73.96 -38.92 64.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.014 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.775 HG22 ' CE1' ' A' ' 74' ' ' TYR . 75.7 t -69.82 -43.04 80.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.936 0.398 . . . . 0.0 110.521 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.77 -50.01 72.29 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.404 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.741 ' HA ' HD12 ' A' ' 48' ' ' LEU . 75.4 m-20 -62.95 -47.34 83.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.376 . . . . 0.0 110.933 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.786 ' HG ' HG11 ' A' ' 29' ' ' VAL . 20.4 mt -50.8 -42.33 58.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' A' ' 51' ' ' ASN . 4.2 mtpt -58.48 -51.73 68.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.48 . . . . 0.0 110.811 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.741 HD12 ' HA ' ' A' ' 45' ' ' ASP . 7.7 mt -53.04 -35.54 59.59 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.941 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.588 HG13 HG13 ' A' ' 50' ' ' ILE . 14.7 p -100.97 3.21 10.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.36 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.88 HG23 ' O ' ' A' ' 55' ' ' ARG . 54.7 mt -139.09 27.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.131 0.491 . . . . 0.0 111.085 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.444 ' N ' ' O ' ' A' ' 47' ' ' LYS . 26.1 p30 -85.54 16.09 4.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.812 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -127.58 140.97 39.51 Favored Pre-proline 0 CA--C 1.523 -0.059 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.59 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HA ' HD12 ' A' ' 56' ' ' LEU . 84.7 Cg_exo -45.33 -38.88 15.78 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.378 2.052 . . . . 0.0 111.881 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 t -69.32 -34.76 75.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.716 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.88 ' O ' HG23 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -89.72 -13.88 35.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.775 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.64 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 12.8 mt -49.0 -51.62 54.09 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.64 ' HD2' ' N ' ' A' ' 56' ' ' LEU . 5.1 Cg_exo -39.97 -28.33 0.25 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.242 2.628 . . . . 0.0 113.893 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.012 HD21 HG13 ' A' ' 13' ' ' VAL . 9.3 mt -63.48 -38.58 91.7 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.644 0.259 . . . . 0.0 111.102 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.481 ' CE1' ' CZ ' ' A' ' 74' ' ' TYR . 0.2 OUTLIER -59.82 -44.0 94.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 0.0 110.674 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -75.1 -31.58 61.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.692 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.808 ' HB1' ' CD1' ' A' ' 9' ' ' PHE . . . -62.82 -60.25 3.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.391 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 1.069 HD11 HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -66.93 -30.01 48.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.829 -179.645 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.474 ' N ' ' HD2' ' A' ' 64' ' ' PRO . 16.1 ttp180 -40.21 -58.08 2.52 Favored Pre-proline 0 N--CA 1.468 0.465 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 63' ' ' ARG . 6.2 Cg_endo -48.48 -30.0 14.92 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.706 2.271 . . . . 0.0 113.125 -178.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.568 HD12 ' CG1' ' A' ' 62' ' ' ILE . 12.9 mt -65.37 -49.61 68.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.482 0.658 . . . . 0.0 109.872 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.484 HG23 ' CB ' ' A' ' 70' ' ' HIS . 0.7 OUTLIER -47.12 133.73 9.08 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.159 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.33 165.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.488 2.125 . . . . 0.0 112.14 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.6 tp -56.46 -57.79 10.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.871 0.367 . . . . 0.0 110.928 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.7 pttt -58.97 -48.93 79.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.081 0.467 . . . . 0.0 110.429 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.484 ' CB ' HG23 ' A' ' 66' ' ' ILE . 38.3 m170 -60.73 -29.21 69.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.386 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -65.66 -42.3 91.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.059 0.457 . . . . 0.0 110.241 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 31.1 t -62.45 -45.35 98.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.362 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.33 -31.88 69.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.458 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.876 ' O ' HG22 ' A' ' 78' ' ' THR . 63.2 t80 -70.75 -41.0 72.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.731 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -37.68 83.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.74 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -66.47 -41.22 89.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.664 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 16.8 mt -68.18 -34.87 77.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.071 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.876 HG22 ' O ' ' A' ' 74' ' ' TYR . 5.1 t -93.07 125.49 54.66 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.972 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.08 -170.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.396 2.064 . . . . 0.0 112.294 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.022 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.541 -0.224 . . . . 0.0 112.541 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' SER . . . . . . . . . . . . . 13.5 m -101.95 105.95 16.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.825 0.345 . . . . 0.0 110.891 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.483 ' HB3' HD22 ' A' ' 65' ' ' LEU . 30.9 mt -83.76 -26.07 29.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.974 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.538 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 0.6 OUTLIER -51.76 -53.2 42.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.855 -179.842 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 pttt -61.2 -31.7 71.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.72 -40.39 94.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.945 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' VAL . . . . . 0.773 HG11 ' CZ ' ' A' ' 9' ' ' PHE . 2.4 t -71.16 -46.5 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.458 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.624 HD21 ' HB3' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -65.08 -45.5 84.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.957 0.408 . . . . 0.0 110.478 179.845 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' GLU . . . . . 0.445 ' HA ' ' CD2' ' B' ' 109' ' ' LEU . 5.0 tt0 -66.03 -37.83 86.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.075 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -64.57 -36.37 84.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.34 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -76.29 -55.96 5.08 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.377 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.582 ' C ' HD12 ' B' ' 109' ' ' LEU . 2.7 pp -51.28 -34.97 35.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.488 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' ARG . . . . . 0.504 ' N ' HD12 ' B' ' 109' ' ' LEU . 17.2 mtt-85 -76.92 -36.43 56.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.917 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.69 HD11 ' HD2' ' A' ' 7' ' ' ARG . 10.9 mt -68.32 -12.44 61.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.429 178.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -70.64 -73.45 0.17 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.943 0.402 . . . . 0.0 110.876 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.881 -179.971 . . . . . . . . 1 1 . 1 stop_ save_