data_7jgi_residue ############################ # Computer software used # ############################ 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 7jgi _Structure_validation_residue.Date_analyzed 2020-08-28 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 ' 4' ' ' ILE . . . . . 0.603 HD13 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.644 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.0 m-30 -72.9 -29.33 63.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.606 178.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.534 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -59.02 -46.49 88.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.579 -0.896 . . . . 0.0 108.579 179.305 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.92 81.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.455 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.67 -40.88 80.39 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.6 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.581 HG23 ' HB3' ' A' ' 78' ' ' LEU . 75.4 t -62.48 -47.3 93.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.626 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.64 -24.76 66.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.648 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -70.47 -36.32 73.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.045 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.574 HD13 ' CD1' ' A' ' 20' ' ' PHE . 57.6 mt -58.53 127.9 34.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.266 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.531 HG22 ' CB ' ' A' ' 16' ' ' GLN . 4.4 t -61.87 171.37 1.68 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -60.69 -39.98 90.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.17 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -48.81 45.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.531 ' CB ' HG22 ' A' ' 13' ' ' THR . 64.5 tt0 -62.61 -42.73 99.75 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.132 0.492 . . . . 0.0 110.585 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.519 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 32.3 ttmt -66.81 -35.24 79.61 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.689 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -59.34 -44.07 92.69 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.488 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -61.84 -44.78 96.14 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.402 0.62 . . . . 0.0 109.957 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.673 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 14.1 m-30 -64.45 -38.66 91.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.766 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 24' ' ' PHE . 24.7 tptm -59.09 -39.76 83.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.88 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.62 93.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.508 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.54 -38.53 87.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.01 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.627 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 17.3 t80 -56.57 -49.56 74.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.607 ' O ' ' N ' ' A' ' 29' ' ' LEU . 61.6 t0 -62.27 -39.23 92.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.263 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.533 ' CG2' HG22 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -56.4 -44.48 80.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.669 179.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.635 ' CZ ' ' CE ' ' A' ' 153' ' ' MET . 16.8 m-85 -62.17 -42.71 99.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.375 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.564 ' O ' ' N ' ' A' ' 31' ' ' ALA . 6.2 m -97.51 11.37 5.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.741 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.607 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -42.03 108.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.06 12.74 58.57 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.564 ' N ' ' O ' ' A' ' 28' ' ' VAL . . . -83.9 128.76 34.77 Favored 'General case' 0 C--N 1.331 -0.239 0 O-C-N 122.777 -0.249 . . . . 0.0 110.555 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -64.18 -40.73 96.72 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.701 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.491 ' OD2' ' OG ' ' A' ' 35' ' ' SER . 0.5 OUTLIER -86.9 -21.96 25.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.565 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 81.35 -1.23 86.11 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.585 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 55.6 p -86.16 135.46 33.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.556 ' HB ' HG11 ' A' ' 72' ' ' VAL . 89.6 mt -76.87 105.65 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.106 0.479 . . . . 0.0 110.709 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.524 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 60.3 p -103.33 177.49 4.83 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.579 HG22 ' N ' ' A' ' 58' ' ' GLN . 6.9 p -53.32 -39.59 64.15 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.043 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -66.47 -44.44 82.71 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.634 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 71.1 mm-40 -73.53 -20.69 60.58 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 109.956 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.585 ' O ' ' HG2' ' A' ' 45' ' ' MET . 0.4 OUTLIER -81.82 -47.37 12.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.54 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.501 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -60.94 -37.94 94.63 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.369 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.634 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -48.69 -57.29 6.51 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.203 0.502 . . . . 0.0 110.276 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.574 HG12 ' CE1' ' A' ' 27' ' ' PHE . 11.8 t -63.67 -35.63 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 CA-C-O 121.097 0.475 . . . . 0.0 110.019 177.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.588 ' SD ' HD11 ' A' ' 148' ' ' ILE . 87.5 mmm -59.06 -41.58 88.26 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.619 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 76.5 mtp85 -66.42 -33.16 75.08 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.556 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 20.5 mtm -59.75 -38.28 81.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.969 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 153' ' ' MET . 79.3 mt -84.19 -1.87 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.857 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.41 8.77 52.25 Favored Glycine 0 CA--C 1.529 0.906 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.619 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 87.0 mm-40 -90.83 138.08 31.86 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.855 0.36 . . . . 0.0 111.078 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.466 ' OD1' ' O ' ' A' ' 51' ' ' ASN . 21.0 t-20 -127.38 60.89 46.1 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.81 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.527 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 81.7 Cg_endo -79.32 139.89 15.02 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.573 2.182 . . . . 0.0 112.169 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.422 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 73.8 p -74.25 152.31 88.09 Favored Pre-proline 0 CA--C 1.516 -0.34 0 CA-C-O 121.037 0.446 . . . . 0.0 110.323 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.13 -43.06 60.0 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 122.722 2.281 . . . . 0.0 112.294 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -62.74 -40.28 96.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.168 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.422 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 0.9 OUTLIER -78.84 -31.89 45.88 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.552 ' C ' HG21 ' A' ' 38' ' ' THR . 3.1 mt -60.96 -26.27 67.42 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.16 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.579 ' N ' HG22 ' A' ' 38' ' ' THR . 37.7 tt0 -58.93 -37.74 77.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.723 -178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -61.58 -41.28 97.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.158 0.504 . . . . 0.0 110.804 178.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.454 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 3.6 mmt -64.51 -42.02 96.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.763 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.525 HG22 ' O ' ' A' ' 70' ' ' GLY . 10.2 mm -61.62 -44.56 98.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.696 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.491 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 66.0 t0 -59.79 -29.91 68.53 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.33 -42.88 10.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.972 0.415 . . . . 0.0 110.338 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.468 HG11 ' HB2' ' A' ' 80' ' ' MET . 0.3 OUTLIER -113.2 -12.34 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.267 179.677 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.507 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 30.7 t70 -91.98 63.24 4.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.399 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -65.21 -21.0 66.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.821 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.512 ' OD2' ' OG ' ' A' ' 69' ' ' SER . 58.7 p-10 -74.67 -8.48 56.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.896 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.74 15.17 75.69 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.512 ' OG ' ' OD2' ' A' ' 67' ' ' ASP . 66.4 m -66.21 -26.74 67.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.927 0.394 . . . . 0.0 110.405 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.525 ' O ' HG22 ' A' ' 61' ' ' ILE . . . 86.41 -1.14 87.34 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.585 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 25.6 p -136.44 133.77 36.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.922 0.391 . . . . 0.0 110.926 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.556 HG11 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -100.48 103.82 15.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.217 0.532 . . . . 0.0 109.972 179.212 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.524 ' OD1' ' HA ' ' A' ' 35' ' ' SER . 18.1 m-20 -72.27 -163.9 0.13 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.302 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.615 ' HE1' ' CD2' ' A' ' 78' ' ' LEU . 1.4 t80 -57.86 -49.88 75.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.004 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -62.99 -42.29 99.8 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.017 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.523 ' CD ' ' HA ' ' A' ' 72' ' ' VAL . 45.5 mt-10 -64.38 -42.09 96.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.385 0.612 . . . . 0.0 111.132 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.673 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -71.33 -41.13 70.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.999 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.615 ' CD2' ' HE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -58.39 -37.22 74.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.846 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.571 ' O ' HG11 ' A' ' 82' ' ' VAL . 42.1 t -60.69 -42.53 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 N-CA-C 109.335 -0.616 . . . . 0.0 109.335 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.468 ' HB2' HG11 ' A' ' 64' ' ' VAL . 1.0 OUTLIER -53.27 -43.53 67.5 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.916 -0.714 . . . . 0.0 110.083 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.417 ' HE1' ' SD ' ' A' ' 154' ' ' MET . 24.7 mmt -60.83 -45.27 95.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.762 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.644 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.437 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.672 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.601 HG22 ' SD ' ' A' ' 153' ' ' MET . 20.8 tt . . . . . 0 C--O 1.231 0.12 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.635 ' O ' ' CB ' ' A' ' 153' ' ' MET . 66.3 m -42.21 96.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 148' ' ' ILE . . . -60.1 -39.1 84.99 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.326 0.391 . . . . 0.0 111.225 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.548 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 40.9 m-20 -50.88 -77.53 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.508 0.67 . . . . 0.0 110.811 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.6 -35.92 81.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.199 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.635 ' CE ' ' CZ ' ' A' ' 27' ' ' PHE . 9.6 ttt -48.49 -53.78 16.73 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.382 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.508 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 2.0 mtp -65.93 -34.0 77.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.09 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.548 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 75.7 mt-30 -59.28 -43.28 92.53 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.62 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.427 ' HB3' ' CD2' ' A' ' 48' ' ' LEU . . . -63.32 -43.97 96.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -63.66 -41.02 98.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.482 -179.156 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.545 -179.662 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.586 HD11 ' CE2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.191 0 CA-C-O 121.293 0.568 . . . . 0.0 109.855 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.649 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 21.6 m-30 -71.01 -29.05 64.89 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.603 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 1.4 mmpt? -58.93 -43.79 91.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.551 0.691 . . . . 0.0 109.282 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.63 -34.17 77.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.157 177.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.95 -41.41 82.77 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.611 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.529 HG21 ' CD1' ' A' ' 78' ' ' LEU . 72.2 t -62.24 -45.76 98.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.119 0.485 . . . . 0.0 109.705 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -70.06 -23.07 63.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.642 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.44 -33.74 67.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.536 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.496 HD13 ' CE1' ' A' ' 20' ' ' PHE . 13.9 mt -62.46 129.42 40.56 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.334 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.583 HG22 ' H ' ' A' ' 16' ' ' GLN . 2.6 t -69.64 -179.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.193 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 79.0 mm-40 -60.85 -45.03 96.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.138 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.85 -49.63 56.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.952 0.406 . . . . 0.0 111.454 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.583 ' H ' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -57.43 -51.31 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.273 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.65 -35.28 79.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.883 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.539 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.9 t-20 -60.04 -43.36 95.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.111 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.6 ' O ' ' HE3' ' A' ' 154' ' ' MET . 17.0 mt-10 -60.0 -51.06 71.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.353 179.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.667 ' CD2' ' SD ' ' A' ' 154' ' ' MET . 42.2 m-85 -62.69 -36.2 82.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.751 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.62 -41.3 85.6 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.423 ' O ' HD11 ' A' ' 26' ' ' ILE . . . -60.67 -42.29 96.78 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.845 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB3' ' HE3' ' A' ' 154' ' ' MET . . . -61.76 -39.14 90.58 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.041 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.595 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 10.0 t80 -55.9 -49.75 72.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.391 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.419 ' O ' ' N ' ' A' ' 29' ' ' LEU . 38.7 t70 -62.45 -41.42 98.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.603 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.549 HD13 ' O ' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -59.96 -42.45 89.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.291 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.646 ' CE1' HG13 ' A' ' 44' ' ' VAL . 5.6 m-85 -61.08 -39.42 89.85 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.33 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.554 HG12 ' O ' ' A' ' 35' ' ' SER . 6.8 m -105.18 24.6 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.597 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -54.72 105.85 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.151 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.03 3.16 59.13 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.479 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -69.37 134.48 49.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 110.46 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -67.84 -42.03 82.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.526 ' OD1' ' O ' ' A' ' 33' ' ' ASP . 67.5 t0 -92.13 -20.83 20.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.389 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.516 ' O ' HG13 ' A' ' 28' ' ' VAL . . . 88.48 -8.3 79.34 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.581 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.8 p -78.13 137.08 38.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.359 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.572 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.9 mt -75.82 107.86 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.893 0.378 . . . . 0.0 111.189 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.616 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 24.3 p -101.28 175.19 5.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.828 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.622 ' N ' HD13 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -55.66 -35.79 66.35 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.363 -179.393 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -71.86 -46.28 58.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.244 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.641 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 33.1 mp0 -72.42 -20.93 61.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.826 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.544 ' O ' ' HG2' ' A' ' 45' ' ' MET . 1.1 tt -82.49 -48.97 10.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.932 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.544 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.57 -37.4 94.67 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.641 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.17 -57.53 4.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.376 -0.485 . . . . 0.0 110.121 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.646 HG13 ' CE1' ' A' ' 27' ' ' PHE . 11.3 t -62.68 -34.35 64.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.051 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.544 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 91.3 mmm -58.59 -42.34 87.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.648 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 34.9 mtp-105 -66.57 -33.28 75.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 109.776 177.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.493 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 16.4 mtm -59.74 -37.08 77.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.865 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.565 ' CD2' ' HB2' ' A' ' 156' ' ' ALA . 69.7 mt -87.06 0.05 55.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.63 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.75 7.69 52.93 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.179 -0.769 . . . . 0.0 111.179 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.648 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 23.1 mm100 -96.06 131.94 41.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 110.831 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.464 ' OD1' ' O ' ' A' ' 51' ' ' ASN . 40.2 t-20 -127.87 60.6 46.64 Favored Pre-proline 0 C--N 1.324 -0.542 0 C-N-CA 120.109 -0.636 . . . . 0.0 110.943 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.509 ' HG3' ' HE3' ' A' ' 45' ' ' MET . 59.7 Cg_endo -76.72 138.35 18.93 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 C-N-CA 122.615 2.21 . . . . 0.0 112.355 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.1 p -72.06 154.06 92.5 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.0 110.502 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.98 -35.65 90.43 Favored 'Trans proline' 0 C--N 1.3 -1.996 0 C-N-CA 122.836 2.357 . . . . 0.0 111.705 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.88 -41.18 97.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.329 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.407 ' O ' ' HE2' ' A' ' 60' ' ' MET . 2.8 mt-10 -81.26 -37.25 28.81 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.086 0.469 . . . . 0.0 110.418 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.516 ' O ' HG13 ' A' ' 61' ' ' ILE . 52.4 mt -61.86 -31.24 71.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.525 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.522 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 46.5 tt0 -59.43 -42.33 91.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.989 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -67.0 -43.12 83.74 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.266 0.555 . . . . 0.0 110.557 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.473 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 3.4 mpp? -60.29 -38.52 83.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.34 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.622 HD13 ' N ' ' A' ' 38' ' ' THR . 1.1 mt -61.93 -46.83 95.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.024 0.44 . . . . 0.0 110.389 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.557 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 60.2 t0 -56.45 -26.7 54.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.396 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 60' ' ' MET . 8.9 tp10 -45.77 -37.65 6.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.068 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.576 HG22 ' SD ' ' A' ' 80' ' ' MET . 0.2 OUTLIER -119.96 -13.77 8.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.741 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.515 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 29.2 t70 -86.39 68.12 10.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.521 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -68.02 -17.17 64.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.67 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -12.66 60.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.62 -178.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.89 2.51 82.09 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.51 ' OG ' ' OD1' ' A' ' 65' ' ' ASP . 89.3 p -65.7 -18.24 65.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.838 0.351 . . . . 0.0 110.748 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.515 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 75.0 13.37 82.73 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.581 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.5 p -138.94 130.86 27.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.03 0.443 . . . . 0.0 110.802 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.572 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -96.45 112.8 29.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.917 179.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 14.0 p-10 -82.11 -165.83 1.1 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.371 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.601 ' CD1' ' HE2' ' A' ' 77' ' ' PHE . 2.1 t80 -57.08 -49.75 74.89 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.711 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -64.51 -44.22 91.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.778 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.493 ' OE1' ' HA ' ' A' ' 65' ' ' ASP . 54.8 mt-10 -64.9 -41.61 95.46 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.211 0.529 . . . . 0.0 110.477 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.638 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -67.53 -40.53 85.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.924 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.58 ' CD2' ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -58.37 -38.95 78.3 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 82' ' ' VAL . 47.1 t -61.57 -40.01 85.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.895 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.576 ' SD ' HG22 ' A' ' 64' ' ' VAL . 32.4 mtm -58.36 -39.97 80.99 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 23.8 mmt -61.35 -43.86 98.15 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.011 0.434 . . . . 0.0 110.583 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.649 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.363 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.573 ' O ' ' CG2' ' A' ' 148' ' ' ILE . 21.1 tt . . . . . 0 N--CA 1.462 0.166 0 CA-C-O 120.853 0.359 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.622 ' O ' ' CB ' ' A' ' 153' ' ' MET . 45.0 t -36.41 107.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.925 -179.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.2 87.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.879 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 65.3 m-20 -55.43 -71.31 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.41 0.624 . . . . 0.0 110.669 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.501 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -62.31 -34.52 76.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.758 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.635 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 6.2 ttt -50.87 -48.92 60.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.449 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.667 ' SD ' ' CD2' ' A' ' 20' ' ' PHE . 1.8 mtp -70.75 -27.89 64.28 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.285 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 86.4 mt-30 -59.37 -45.67 90.8 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.156 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.565 ' HB2' ' CD2' ' A' ' 48' ' ' LEU . . . -75.98 -29.32 58.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.253 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.607 ' CD1' ' CE1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -60.27 -40.18 89.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.689 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.418 HD23 ' HB1' ' A' ' 22' ' ' ALA . 65.9 mt . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.988 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.569 HG23 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.328 0 CA-C-O 121.429 0.633 . . . . 0.0 109.527 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.628 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.5 m-30 -71.05 -31.8 68.34 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.373 0.606 . . . . 0.0 109.584 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.491 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -57.17 -45.03 84.03 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.017 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.525 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -63.98 -35.89 82.18 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.177 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.54 ' HB2' ' O ' ' A' ' 5' ' ' TYR . . . -56.48 -40.38 74.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.641 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.582 ' CG2' ' HB3' ' A' ' 78' ' ' LEU . 79.7 t -62.07 -46.59 96.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.69 -24.35 63.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.628 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 23.5 mm100 -70.38 -36.94 74.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.635 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.594 HD13 ' CD1' ' A' ' 20' ' ' PHE . 23.4 mt -59.9 110.35 1.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.498 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.515 HG21 ' HB2' ' A' ' 16' ' ' GLN . 5.0 t -53.92 177.88 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.186 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 24.0 pt-20 -56.98 -37.48 71.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.694 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.425 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 79.3 tt0 -75.4 -46.93 29.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.197 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.515 ' HB2' HG21 ' A' ' 13' ' ' THR . 11.3 mt-30 -59.85 -48.51 81.39 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.794 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.461 ' CG ' ' HZ ' ' A' ' 74' ' ' PHE . 26.1 ttmt -65.6 -33.36 75.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.503 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 66.6 t30 -60.55 -43.44 97.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.292 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.52 ' O ' ' HE1' ' A' ' 154' ' ' MET . 1.1 tt0 -62.05 -51.78 66.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.408 0.623 . . . . 0.0 109.905 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.669 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 68.7 m-85 -65.31 -37.76 88.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.053 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -58.01 -40.8 81.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.737 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.599 ' O ' ' CD1' ' A' ' 26' ' ' ILE . . . -61.01 -41.83 97.29 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.533 ' HB3' ' CE ' ' A' ' 154' ' ' MET . . . -60.05 -38.6 83.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.052 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.626 ' CZ ' ' O ' ' A' ' 34' ' ' GLY . 41.6 t80 -57.37 -48.83 78.02 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.553 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 29' ' ' LEU . 67.0 t0 -61.55 -41.3 97.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.312 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.599 ' CD1' ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -59.54 -45.38 93.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.535 179.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.605 ' CE1' HG13 ' A' ' 44' ' ' VAL . 16.0 m-85 -61.13 -40.54 94.18 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.353 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.579 HG13 ' CG1' ' A' ' 36' ' ' ILE . 15.0 m -104.27 23.82 2.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.419 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.57 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -52.67 106.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 -179.61 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.34 7.01 67.9 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.529 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -65.52 135.59 55.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.743 0.306 . . . . 0.0 110.389 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.99 -41.39 95.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.175 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.3 p30 -96.91 -19.6 18.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.845 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.626 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 86.97 -8.62 75.57 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.59 ' CB ' ' OD1' ' A' ' 73' ' ' ASP . 54.6 p -80.91 136.42 36.05 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.579 ' CG1' HG13 ' A' ' 28' ' ' VAL . 96.5 mt -72.94 104.75 2.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.834 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.557 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 87.2 p -99.79 159.96 14.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.549 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.637 ' N ' HD12 ' A' ' 61' ' ' ILE . 1.3 p -41.57 -32.59 0.37 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.35 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -74.73 -43.42 55.09 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.172 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.621 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 4.8 mm-40 -74.49 -21.97 59.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.344 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 45' ' ' MET . 3.4 tt -83.32 -50.15 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.839 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.48 -37.13 94.18 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.621 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -46.4 -59.89 2.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 117.236 0.518 . . . . 0.0 109.986 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.605 HG13 ' CE1' ' A' ' 27' ' ' PHE . 9.6 t -62.03 -34.09 61.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.602 ' O ' ' N ' ' A' ' 50' ' ' GLN . 88.5 mmm -58.5 -43.31 89.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.009 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.609 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 21.7 mtt180 -67.24 -32.48 73.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.192 0.52 . . . . 0.0 109.73 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 26.0 mtm -60.79 -37.18 81.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.063 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.592 ' CD1' ' HA ' ' A' ' 153' ' ' MET . 57.3 mt -89.79 3.84 51.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.537 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.6 -3.62 57.74 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.609 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 8.2 mm100 -85.31 129.52 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.787 0.327 . . . . 0.0 111.137 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -129.19 61.44 57.14 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.906 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.539 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 58.7 Cg_endo -73.8 143.86 34.07 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 C-N-CA 122.542 2.161 . . . . 0.0 112.29 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.4 p -73.63 156.98 88.19 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 121.202 0.525 . . . . 0.0 110.551 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.85 -40.24 73.98 Favored 'Trans proline' 0 C--N 1.299 -2.059 0 C-N-CA 122.791 2.327 . . . . 0.0 112.017 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 52.5 mp0 -62.69 -40.4 97.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.391 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HE2' ' A' ' 60' ' ' MET . 1.6 tp10 -78.52 -37.77 42.27 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.44 0.638 . . . . 0.0 109.788 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.539 ' HG ' ' HB2' ' A' ' 52' ' ' PRO . 33.0 mt -61.05 -35.65 77.48 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.476 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.455 ' N ' HG21 ' A' ' 38' ' ' THR . 0.2 OUTLIER -59.0 -41.77 88.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.403 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -63.47 -41.67 98.59 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 110.028 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.47 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -65.14 -40.99 95.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.637 HD12 ' N ' ' A' ' 38' ' ' THR . 2.6 mt -61.61 -47.09 94.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.803 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.575 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 39.1 t70 -60.28 -29.37 68.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.719 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -54.23 -38.18 65.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.208 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.501 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 2.2 m -110.51 0.86 9.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.044 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.615 ' OD2' ' N ' ' A' ' 69' ' ' SER . 57.3 t0 -85.2 109.21 18.15 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.128 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.48 -49.09 72.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.982 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.555 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 51.8 p30 -89.34 -6.18 56.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.755 0.312 . . . . 0.0 110.673 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.46 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 65.66 27.04 72.25 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.615 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.1 p -68.52 4.22 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.858 0.361 . . . . 0.0 110.73 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.556 ' C ' HG23 ' A' ' 61' ' ' ILE . . . 74.77 16.08 80.48 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.587 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 4.6 p -141.31 128.91 21.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.601 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 0.2 OUTLIER -98.95 103.91 15.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.448 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.59 ' OD1' ' CB ' ' A' ' 35' ' ' SER . 66.4 m-20 -74.58 -164.96 0.31 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.39 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.587 ' HE1' ' CD2' ' A' ' 78' ' ' LEU . 4.4 t80 -57.21 -48.48 78.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.63 -48.39 75.05 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.784 0.326 . . . . 0.0 110.823 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.601 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 52.5 mt-10 -62.36 -41.68 98.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.289 0.566 . . . . 0.0 110.463 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.669 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -67.51 -41.15 84.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.057 0.456 . . . . 0.0 109.823 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.605 HD22 ' CE2' ' A' ' 77' ' ' PHE . 0.1 OUTLIER -56.07 -40.65 73.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.595 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.599 ' O ' HG12 ' A' ' 82' ' ' VAL . 43.9 t -61.08 -42.62 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.49 ' HB2' HG11 ' A' ' 64' ' ' VAL . 4.3 ttm -52.22 -44.77 64.99 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.6 mmt -60.28 -46.3 90.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.998 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.628 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.653 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.599 ' CG2' ' O ' ' A' ' 148' ' ' ILE . 19.3 tt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 121.195 0.521 . . . . 0.0 110.366 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.578 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -34.54 107.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.278 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.446 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.73 -39.19 83.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.569 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -43.28 -84.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.346 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' A' ' 155' ' ' GLN . . . -61.19 -33.91 74.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.226 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.596 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 6.3 ttt -48.22 -49.78 31.78 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.288 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.533 ' CE ' ' HB3' ' A' ' 23' ' ' ALA . 3.6 mtp -76.42 -27.04 56.13 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.534 179.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.569 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 76.0 mt-30 -60.37 -43.19 96.81 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.338 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.528 ' HB2' ' CD2' ' A' ' 48' ' ' LEU . . . -64.1 -44.68 91.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.024 0.44 . . . . 0.0 110.682 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -62.46 -43.17 99.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.582 -179.287 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.516 HD21 ' CB ' ' A' ' 22' ' ' ALA . 90.1 mt . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.231 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.611 HD12 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.205 0.526 . . . . 0.0 109.651 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.6 m-30 -71.29 -29.69 65.36 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.73 -45.73 88.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.07 -34.56 78.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.288 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 5' ' ' TYR . . . -58.12 -40.83 82.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.847 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.549 HG23 HD13 ' A' ' 78' ' ' LEU . 94.0 t -62.87 -45.52 98.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -69.94 -26.98 64.39 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.412 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 12.1 mm100 -69.57 -37.9 77.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.588 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.545 HD23 ' OE1' ' A' ' 16' ' ' GLN . 20.2 mt -56.36 128.49 36.16 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.281 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.487 HG23 ' HG3' ' A' ' 16' ' ' GLN . 9.0 t -63.65 179.4 0.48 Allowed 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.092 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -61.4 -41.1 96.6 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.464 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -69.93 -42.12 73.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.84 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.545 ' OE1' HD23 ' A' ' 12' ' ' LEU . 71.4 mt-30 -61.89 -43.5 98.72 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.484 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 5.8 mtmt -71.96 -30.18 65.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.813 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -62.2 -49.05 77.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.227 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.583 ' O ' ' CE ' ' A' ' 154' ' ' MET . 64.4 mt-10 -63.14 -44.72 94.77 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.418 0.627 . . . . 0.0 110.37 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.65 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 39.0 m-85 -67.74 -37.07 81.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.674 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.456 ' N ' ' O ' ' A' ' 17' ' ' LYS . 29.1 tptp -60.78 -40.32 92.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.846 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.592 ' O ' ' CD1' ' A' ' 26' ' ' ILE . . . -60.01 -42.97 95.45 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.76 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.525 ' O ' ' HD1' ' A' ' 27' ' ' PHE . . . -61.07 -39.62 90.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.825 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.599 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 16.3 t80 -56.65 -48.8 76.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.645 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 29' ' ' LEU . 6.3 t70 -61.72 -41.67 97.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.827 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.592 ' CD1' ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.26 -44.46 83.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.667 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.601 ' CZ ' ' CG1' ' A' ' 44' ' ' VAL . 21.3 m-85 -61.92 -40.96 97.27 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.342 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.551 HG12 ' O ' ' A' ' 35' ' ' SER . 31.4 m -106.46 25.38 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.458 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.605 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -54.0 111.17 0.7 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.253 -179.519 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.84 3.06 83.67 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.503 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -62.66 136.6 57.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.353 . . . . 0.0 110.301 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 61.9 mp0 -64.81 -40.31 94.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.46 ' OD1' ' HB3' ' A' ' 35' ' ' SER . 11.0 t70 -96.98 -22.81 16.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.741 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.435 ' O ' HG13 ' A' ' 28' ' ' VAL . . . 89.07 -8.85 78.88 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.577 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 81.4 p -79.69 136.46 36.79 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.563 ' O ' ' HA ' ' A' ' 71' ' ' THR . 94.6 mt -73.77 104.15 2.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.551 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 83.5 p -97.01 168.09 10.67 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.073 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.663 ' N ' ' CD1' ' A' ' 61' ' ' ILE . 0.8 OUTLIER -49.16 -38.21 24.83 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.552 -179.471 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.45 -49.17 57.53 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.133 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.551 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 1.4 mp0 -64.51 -43.83 92.83 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.07 0.462 . . . . 0.0 110.743 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.59 HD23 ' SD ' ' A' ' 60' ' ' MET . 4.0 tt -64.98 -49.81 68.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.133 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.58 -31.83 79.17 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.118 -1.193 . . . . 0.0 110.118 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HE3' ' O ' ' A' ' 26' ' ' ILE . 0.0 OUTLIER -54.33 -54.05 45.56 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.648 ' CG2' ' SD ' ' A' ' 47' ' ' MET . 1.1 t -66.1 -32.22 57.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.59 ' SD ' HD11 ' A' ' 148' ' ' ILE . 89.5 mmm -59.18 -43.38 92.19 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 78.5 mtp85 -66.98 -37.85 84.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.703 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.648 ' SD ' ' CG2' ' A' ' 44' ' ' VAL . 1.3 ptm -55.08 -29.15 56.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.488 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.567 ' N ' ' HG2' ' A' ' 47' ' ' MET . 32.0 mt -94.79 0.02 54.56 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.808 -179.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.42 5.64 54.02 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.686 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 14.8 mm100 -88.86 135.68 33.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.926 0.393 . . . . 0.0 111.242 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.515 ' ND2' HH12 ' A' ' 46' ' ' ARG . 51.4 t-20 -128.67 60.45 49.25 Favored Pre-proline 0 C--N 1.32 -0.705 0 C-N-CA 119.474 -0.891 . . . . 0.0 111.089 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG3' ' HE3' ' A' ' 45' ' ' MET . 71.6 Cg_endo -77.05 144.69 24.04 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 C-N-CA 122.659 2.239 . . . . 0.0 112.471 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 p -80.68 153.53 73.2 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.101 0.477 . . . . 0.0 110.458 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.31 -36.69 94.19 Favored 'Trans proline' 0 C--N 1.3 -2.0 0 C-N-CA 122.792 2.328 . . . . 0.0 111.978 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.4 mp0 -62.45 -39.87 94.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.433 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -81.96 -34.42 29.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.908 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.566 ' CB ' HG23 ' A' ' 38' ' ' THR . 32.6 mt -64.93 -39.24 93.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.851 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.607 ' N ' HG23 ' A' ' 38' ' ' THR . 7.1 mt-30 -53.53 -50.18 66.02 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.839 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -62.92 -44.05 97.12 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.582 0.706 . . . . 0.0 109.953 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.59 ' SD ' HD23 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -58.52 -42.91 88.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.134 179.104 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.663 ' CD1' ' N ' ' A' ' 38' ' ' THR . 3.2 mt -60.61 -47.72 91.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.971 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.601 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 18.7 t70 -56.54 -22.31 32.27 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.578 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.448 ' HB3' ' O ' ' A' ' 60' ' ' MET . 51.6 tp10 -49.97 -39.54 41.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.528 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -115.1 -4.97 11.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.911 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.612 ' OD2' ' N ' ' A' ' 69' ' ' SER . 53.4 t0 -72.04 114.81 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.602 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -64.63 -46.5 82.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.58 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 59.5 p30 -94.06 -6.27 45.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.868 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.447 ' C ' ' H ' ' A' ' 70' ' ' GLY . . . 68.12 23.1 74.61 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.612 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.4 p -69.61 5.72 1.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.836 0.35 . . . . 0.0 110.699 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.611 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.68 17.52 80.0 Favored Glycine 0 CA--C 1.518 0.257 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.1 p -138.71 122.37 17.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.922 0.392 . . . . 0.0 111.106 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.619 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 0.2 OUTLIER -99.97 106.19 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.195 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.499 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.7 m-20 -73.62 -166.79 0.39 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.507 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.589 ' HE1' ' CD2' ' A' ' 78' ' ' LEU . 0.8 OUTLIER -57.85 -51.09 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.248 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -63.14 -43.51 98.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.859 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.619 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 68.6 mt-10 -64.62 -39.04 93.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.65 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -72.35 -39.18 68.3 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.198 0.523 . . . . 0.0 110.279 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.589 ' CD2' ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.7 -36.58 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -179.352 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.67 ' O ' HG12 ' A' ' 82' ' ' VAL . 48.8 t -59.95 -40.43 82.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.315 0.578 . . . . 0.0 109.732 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.417 ' HB2' HG11 ' A' ' 64' ' ' VAL . 9.5 ttt -57.2 -43.09 82.4 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.857 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.431 ' HG3' ' CD2' ' A' ' 20' ' ' PHE . 38.8 mmt -60.19 -47.5 85.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.113 0.482 . . . . 0.0 110.547 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.67 HG12 ' O ' ' A' ' 79' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.377 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.59 HD11 ' SD ' ' A' ' 45' ' ' MET . 15.9 tt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.741 0.305 . . . . 0.0 110.346 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.504 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.7 OUTLIER -38.49 102.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.249 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.441 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.66 -39.64 89.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.725 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.535 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 3.5 t0 -45.89 -79.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.134 0.492 . . . . 0.0 110.659 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.406 ' H ' ' HB3' ' A' ' 151' ' ' ASP . . . -61.16 -35.53 77.36 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.762 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.589 ' O ' ' HG ' ' A' ' 157' ' ' LEU . 11.0 ttt -48.0 -51.6 23.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.323 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.583 ' CE ' ' O ' ' A' ' 19' ' ' GLU . 1.6 mtp -70.44 -30.16 66.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.363 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.535 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 21.9 mt-30 -60.8 -42.54 97.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.022 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.448 ' HB1' HD21 ' A' ' 48' ' ' LEU . . . -64.02 -43.79 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.486 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.2 OUTLIER -66.49 -42.79 86.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.675 -179.32 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 154' ' ' MET . 75.1 mt . . . . . 0 C--N 1.326 -0.423 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.194 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.556 HG22 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.206 0 CA-C-O 121.422 0.63 . . . . 0.0 110.098 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.626 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.9 m-30 -70.3 -32.04 69.64 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HZ3' ' HB3' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -57.66 -44.02 85.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.491 0.662 . . . . 0.0 109.223 178.963 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.78 76.73 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.255 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 5' ' ' TYR . . . -57.86 -40.33 79.92 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.588 HG22 ' CD1' ' A' ' 78' ' ' LEU . 83.8 t -62.84 -45.36 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.42 -23.81 62.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.395 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.38 -34.63 70.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.842 -179.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.599 HD12 ' CE1' ' A' ' 20' ' ' PHE . 15.7 mt -61.55 123.99 19.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.575 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.534 ' OG1' ' N ' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -60.88 -179.14 0.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.659 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.534 ' N ' ' OG1' ' A' ' 13' ' ' THR . 49.3 tp10 -60.34 -48.37 82.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.892 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -65.69 -43.25 89.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.012 0.434 . . . . 0.0 110.847 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.523 ' H ' HG23 ' A' ' 13' ' ' THR . 4.6 mt-30 -58.17 -50.83 72.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.748 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HD3' ' HZ ' ' A' ' 74' ' ' PHE . 21.3 ttmt -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.955 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -61.11 -46.32 91.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.082 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.464 ' O ' ' CE ' ' A' ' 154' ' ' MET . 0.4 OUTLIER -64.64 -46.08 84.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.487 0.661 . . . . 0.0 110.168 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.667 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 43.8 m-85 -62.34 -37.11 84.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.735 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.402 ' NZ ' ' HB2' ' A' ' 74' ' ' PHE . 57.8 tptt -58.56 -38.89 78.81 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.547 ' O ' ' CD1' ' A' ' 26' ' ' ILE . . . -60.32 -41.56 93.78 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.529 ' CB ' ' HE3' ' A' ' 154' ' ' MET . . . -61.67 -38.71 88.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.851 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.645 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 14.1 t80 -58.29 -49.27 77.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.768 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' A' ' 29' ' ' LEU . 57.4 t0 -61.97 -40.79 96.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.547 ' CD1' ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -57.91 -44.78 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.812 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.665 ' CE1' HG13 ' A' ' 44' ' ' VAL . 16.7 m-85 -63.46 -38.12 89.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.049 0.452 . . . . 0.0 110.504 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.559 HG12 ' C ' ' A' ' 35' ' ' SER . 6.9 m -104.71 21.09 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.684 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.546 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -55.76 101.76 0.06 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.384 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.88 5.06 54.05 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.417 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -69.14 139.17 54.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.682 0.277 . . . . 0.0 110.62 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -66.79 -42.33 86.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.305 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.531 ' OD2' ' OG ' ' A' ' 35' ' ' SER . 56.4 p-10 -99.98 -15.49 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.537 ' O ' HG13 ' A' ' 28' ' ' VAL . . . 89.28 -8.63 79.41 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.615 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 52.7 p -75.73 135.47 40.35 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.602 ' HB ' HG12 ' A' ' 72' ' ' VAL . 85.4 mt -74.71 106.22 4.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.549 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 38.7 t -101.26 157.87 16.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.068 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.631 ' N ' ' CD1' ' A' ' 61' ' ' ILE . 0.8 OUTLIER -39.16 -43.53 1.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.53 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.11 -41.75 90.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 110.361 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.624 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 6.9 mp0 -75.8 -21.7 57.08 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.454 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.578 ' O ' ' HG2' ' A' ' 45' ' ' MET . 2.6 tt -83.84 -47.94 10.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.842 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.542 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.09 -38.99 96.49 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.624 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.74 -57.87 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.152 0.501 . . . . 0.0 110.283 179.347 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.665 HG13 ' CE1' ' A' ' 27' ' ' PHE . 37.1 t -62.56 -35.02 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.056 177.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.578 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 90.5 mmm -56.53 -43.18 79.58 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.726 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 50.9 mtp180 -64.44 -35.49 81.1 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.074 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.51 ' HE1' ' HA ' ' A' ' 44' ' ' VAL . 19.1 mtm -60.32 -28.59 68.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.116 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.59 ' CD2' ' HB1' ' A' ' 156' ' ' ALA . 24.7 mt -95.81 5.56 51.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.222 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 95.73 -2.14 64.24 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.592 -1.003 . . . . 0.0 110.592 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.726 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -84.76 135.93 33.92 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 110.869 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.448 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 24.1 p30 -129.97 58.83 40.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.223 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.534 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 65.8 Cg_endo -80.33 146.54 17.6 Favored 'Trans proline' 0 C--N 1.304 -1.808 0 C-N-CA 122.787 2.325 . . . . 0.0 111.926 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 p -80.02 153.08 74.79 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.62 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.23 -40.8 79.8 Favored 'Trans proline' 0 C--N 1.301 -1.93 0 C-N-CA 122.839 2.359 . . . . 0.0 112.081 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.5 mp0 -62.49 -39.32 93.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.29 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.494 ' O ' ' HE1' ' A' ' 60' ' ' MET . 0.2 OUTLIER -80.54 -34.14 35.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.42 179.65 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 52' ' ' PRO . 16.3 mt -62.04 -29.48 70.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.713 179.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.544 ' N ' HG22 ' A' ' 38' ' ' THR . 1.0 OUTLIER -56.44 -36.4 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.46 -179.585 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -62.27 -48.75 78.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 0.0 110.901 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.658 ' N ' ' SD ' ' A' ' 60' ' ' MET . 2.0 mpp? -63.53 -39.48 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.524 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.631 ' CD1' ' N ' ' A' ' 38' ' ' THR . 1.5 mt -61.96 -44.74 99.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.193 0.52 . . . . 0.0 110.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.524 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.9 t70 -59.01 -35.48 73.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.587 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -51.5 -42.46 61.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.684 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.446 HG11 ' HB2' ' A' ' 80' ' ' MET . 3.1 m -106.63 3.54 10.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.681 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.55 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 34.5 t70 -107.74 90.34 3.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.366 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -79.57 -19.18 50.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.37 -11.95 60.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.643 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.48 19.09 68.48 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.0 p -86.32 -7.9 58.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.832 0.348 . . . . 0.0 110.875 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.541 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 74.06 17.45 79.48 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.626 -0.989 . . . . 0.0 110.626 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.615 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.1 p -137.48 128.59 27.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.044 0.449 . . . . 0.0 110.613 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.602 HG12 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -97.58 105.43 17.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.503 179.649 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.0 m-20 -74.11 -161.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.69 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.6 ' HD1' ' CE2' ' A' ' 77' ' ' PHE . 1.7 t80 -58.79 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.874 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.414 ' HB3' ' HZ3' ' A' ' 6' ' ' LYS . 96.8 m-20 -63.62 -42.48 98.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.632 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.55 ' OE1' ' HA ' ' A' ' 65' ' ' ASP . 48.0 mt-10 -66.37 -41.38 89.53 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.311 0.577 . . . . 0.0 110.577 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.667 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -67.85 -37.83 82.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.936 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.618 HD21 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -59.1 -40.68 86.06 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.692 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.619 ' O ' HG13 ' A' ' 82' ' ' VAL . 53.8 t -62.15 -39.21 83.09 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.094 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.587 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.449 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 1.4 ttm -57.02 -42.99 81.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.249 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.564 ' CE ' ' HE3' ' A' ' 153' ' ' MET . 22.1 mmt -60.51 -45.38 94.0 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.035 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.626 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.494 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.518 ' O ' ' CG2' ' A' ' 148' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.684 0.278 . . . . 0.0 110.483 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.62 ' O ' ' CB ' ' A' ' 153' ' ' MET . 12.5 m -87.95 102.2 14.5 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -52.48 -34.99 51.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.413 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.582 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 16.2 t0 -56.79 -80.07 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.231 0.539 . . . . 0.0 110.456 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.551 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -61.57 -34.36 75.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.646 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 4.9 ttt -45.64 -61.45 1.7 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.073 0.463 . . . . 0.0 110.252 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.529 ' HE3' ' CB ' ' A' ' 23' ' ' ALA . 6.5 mtp -63.91 -28.19 69.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.185 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 72.8 mt-30 -60.75 -40.64 93.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.194 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.59 ' HB1' ' CD2' ' A' ' 48' ' ' LEU . . . -65.0 -39.92 94.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.392 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.531 ' HB3' ' CG1' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -73.89 -46.47 44.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.583 -179.494 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 154' ' ' MET . 83.9 mt . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.828 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.571 HG21 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.09 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.629 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.9 m-30 -71.66 -31.86 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -46.09 82.91 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.531 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.4 -35.61 81.45 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.565 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.32 -40.37 77.78 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.568 HG22 ' CD1' ' A' ' 78' ' ' LEU . 92.3 t -61.07 -47.14 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -69.12 -30.65 68.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.095 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.531 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 92.4 mm-40 -69.4 -36.56 76.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.924 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.596 HD11 ' CD1' ' A' ' 20' ' ' PHE . 13.5 mt -51.4 125.37 14.18 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.797 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.558 ' CG2' ' H ' ' A' ' 16' ' ' GLN . 9.9 t -60.66 167.9 2.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.259 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.525 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.8 tm-20 -60.08 -42.27 94.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.777 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -70.8 -50.7 32.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.163 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.558 ' H ' ' CG2' ' A' ' 13' ' ' THR . 5.9 tt0 -61.89 -44.76 96.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.143 0.497 . . . . 0.0 110.333 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.547 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -66.56 -33.43 75.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.773 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 65.0 t30 -58.25 -42.58 86.71 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.99 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.4 ' O ' ' HE1' ' A' ' 154' ' ' MET . 24.1 mt-10 -62.67 -45.48 92.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.032 0.444 . . . . 0.0 110.051 179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.64 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 12.8 m-85 -64.81 -38.98 92.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.343 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.7 tptp -59.68 -40.93 89.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.727 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.503 ' O ' ' CD1' ' A' ' 26' ' ' ILE . . . -60.79 -41.77 96.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.489 ' O ' ' HD1' ' A' ' 27' ' ' PHE . . . -61.83 -38.76 89.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.004 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.639 ' HB2' ' CE2' ' A' ' 77' ' ' PHE . 23.2 t80 -57.4 -49.13 77.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.649 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.542 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.42 -39.16 92.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.384 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.522 ' HA ' ' CD1' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -57.06 -47.44 83.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.627 -179.772 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.617 ' CE1' HG13 ' A' ' 44' ' ' VAL . 25.4 m-85 -61.88 -42.27 98.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.494 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.539 ' CG1' ' HA ' ' A' ' 36' ' ' ILE . 18.9 m -101.2 22.91 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.657 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.542 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -57.75 100.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.408 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.97 -5.58 53.45 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.453 ' HB1' ' HB ' ' A' ' 28' ' ' VAL . . . -60.17 138.24 57.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.835 0.35 . . . . 0.0 110.514 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.87 -41.21 91.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.996 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.66 -22.97 19.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.778 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 28' ' ' VAL . . . 89.0 -9.38 77.02 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.535 ' C ' HG12 ' A' ' 28' ' ' VAL . 89.3 p -82.72 136.2 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.6 ' HB ' ' O ' ' A' ' 72' ' ' VAL . 96.4 mt -69.05 104.8 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.597 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.615 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 8.9 p -98.63 156.33 16.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.669 ' N ' ' CD1' ' A' ' 61' ' ' ILE . 0.1 OUTLIER -39.48 -38.48 0.58 Allowed 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.481 -179.277 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.76 -46.06 76.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.976 0.417 . . . . 0.0 110.171 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.615 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 6.7 mp0 -68.75 -39.42 80.3 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.644 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.621 ' O ' ' HG2' ' A' ' 45' ' ' MET . 6.4 tt -60.5 -49.05 79.09 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.444 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.577 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.09 -36.27 92.69 Favored Glycine 0 CA--C 1.531 1.033 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.459 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -51.23 -62.93 1.32 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.039 0.447 . . . . 0.0 109.99 179.596 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.617 HG13 ' CE1' ' A' ' 27' ' ' PHE . 4.7 t -58.8 -30.88 43.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.903 178.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.621 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 81.4 mmm -59.18 -41.99 89.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.281 -0.418 . . . . 0.0 109.874 179.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.678 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 77.1 mtp180 -67.61 -31.26 71.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.031 0.443 . . . . 0.0 109.847 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.462 ' HE1' ' HA ' ' A' ' 44' ' ' VAL . 19.8 mtm -61.59 -35.96 79.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.098 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.562 ' CD2' ' HB2' ' A' ' 156' ' ' ALA . 11.0 mt -90.3 2.64 55.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.568 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.69 -1.0 56.72 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.678 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 28.1 mm100 -86.0 134.72 33.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.855 0.359 . . . . 0.0 110.855 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.598 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 31.8 p30 -131.41 60.1 50.17 Favored Pre-proline 0 C--N 1.326 -0.429 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.4 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HD3' ' N ' ' A' ' 51' ' ' ASN . 3.6 Cg_exo -75.9 157.83 38.85 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 C-N-CA 123.519 2.812 . . . . 0.0 112.124 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.4 p -89.28 154.2 48.95 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.03 0.443 . . . . 0.0 110.389 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.61 -42.02 71.92 Favored 'Trans proline' 0 C--N 1.302 -1.916 0 C-N-CA 122.716 2.277 . . . . 0.0 112.031 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.16 -44.76 95.89 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.887 0.375 . . . . 0.0 110.262 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.592 ' O ' ' SD ' ' A' ' 60' ' ' MET . 54.2 tp10 -71.64 -38.53 70.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.167 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.638 ' O ' ' HG2' ' A' ' 60' ' ' MET . 41.9 mt -60.62 -24.11 65.25 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.759 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.45 ' N ' HG23 ' A' ' 38' ' ' THR . 34.9 tt0 -64.3 -39.9 94.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.827 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -61.1 -44.14 97.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.108 0.48 . . . . 0.0 110.758 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.638 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -67.53 -39.67 85.05 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.346 179.585 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.669 ' CD1' ' N ' ' A' ' 38' ' ' THR . 1.4 mt -61.52 -46.06 97.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 38.2 t70 -59.19 -37.45 77.46 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.589 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.4 tt0 -47.44 -35.03 7.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.543 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.57 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 2.5 m -118.51 6.11 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.682 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.455 ' OD2' ' N ' ' A' ' 70' ' ' GLY . 59.0 t0 -117.08 83.24 1.94 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.06 -17.42 63.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 -13.0 60.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.522 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.22 13.68 60.47 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.3 p -76.58 -12.54 60.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.698 0.285 . . . . 0.0 110.995 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.537 ' C ' HG22 ' A' ' 61' ' ' ILE . . . 75.02 16.29 80.65 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.565 ' HA ' ' O ' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -134.48 115.24 13.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.978 0.418 . . . . 0.0 111.101 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.6 ' O ' ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -90.58 105.55 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.199 179.311 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.531 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -72.69 -162.97 0.11 Allowed 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.65 179.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.564 ' HD1' ' CE2' ' A' ' 77' ' ' PHE . 0.7 OUTLIER -58.1 -51.41 69.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.811 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -65.33 -42.27 93.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.711 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.57 ' O ' ' HB ' ' A' ' 64' ' ' VAL . 53.0 mt-10 -62.36 -42.24 99.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.451 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.64 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -73.89 -42.86 60.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.127 0.489 . . . . 0.0 110.142 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.59 HD22 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -52.11 -34.77 45.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.732 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.636 ' O ' HG13 ' A' ' 82' ' ' VAL . 46.4 t -60.58 -44.06 95.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.002 178.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 5.2 ptp -56.97 -40.1 75.87 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.053 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.545 ' HE1' ' CG ' ' A' ' 80' ' ' MET . 35.2 mmt -61.55 -45.43 94.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.146 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.636 HG13 ' O ' ' A' ' 79' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.213 179.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.52 ' CD1' ' HG3' ' A' ' 153' ' ' MET . 20.7 tt . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.763 0.316 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.646 ' O ' ' CB ' ' A' ' 153' ' ' MET . 43.0 m -76.17 84.07 3.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -44.28 -37.64 3.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.61 -88.24 0.0 OUTLIER 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.261 0.553 . . . . 0.0 110.907 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.13 -25.95 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.759 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.646 ' CB ' ' O ' ' A' ' 149' ' ' SER . 0.0 OUTLIER -52.36 -49.87 63.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.454 179.754 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.489 ' SD ' ' HD2' ' A' ' 20' ' ' PHE . 1.9 mtp -69.74 -31.47 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.479 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -60.23 -41.87 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.313 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.562 ' HB2' ' CD2' ' A' ' 48' ' ' LEU . . . -65.76 -43.66 88.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.033 0.444 . . . . 0.0 110.966 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -63.24 -44.63 94.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.577 -179.433 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 83.2 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.221 -179.676 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.628 HG21 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.382 0 CA-C-O 121.37 0.605 . . . . 0.0 109.476 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.635 ' CD2' HG22 ' A' ' 82' ' ' VAL . 21.0 m-30 -71.88 -30.25 65.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.534 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.2 mmpt? -57.56 -46.11 84.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.553 0.692 . . . . 0.0 109.194 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 11' ' ' GLN . . . -63.87 -35.28 80.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.157 177.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.516 ' HB2' ' O ' ' A' ' 5' ' ' TYR . . . -57.37 -40.95 79.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.663 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.562 HG21 HD11 ' A' ' 78' ' ' LEU . 75.7 t -62.9 -46.28 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -73.6 -20.42 60.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.038 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.474 ' N ' ' O ' ' A' ' 7' ' ' ALA . 2.8 mt-30 -71.06 -36.25 72.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.86 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.617 HD11 ' CD1' ' A' ' 20' ' ' PHE . 31.3 mt -56.41 128.01 33.86 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.557 HG22 ' CB ' ' A' ' 16' ' ' GLN . 7.5 t -60.67 167.7 2.58 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.959 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -55.42 -39.75 70.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.835 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -74.18 -46.84 39.57 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.745 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.557 ' CB ' HG22 ' A' ' 13' ' ' THR . 65.5 tt0 -62.68 -43.97 97.45 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.964 0.411 . . . . 0.0 110.588 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.542 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 30.8 ttmt -65.61 -35.55 81.14 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -60.51 -43.71 96.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.853 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -62.66 -46.5 87.91 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.683 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 23.5 m-85 -65.07 -39.45 93.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.876 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -59.36 -39.94 84.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.747 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.52 ' O ' HD11 ' A' ' 26' ' ' ILE . . . -60.03 -41.27 91.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.71 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.539 ' HB1' ' CE ' ' A' ' 154' ' ' MET . . . -60.69 -39.73 89.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.999 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.645 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 29.8 t80 -57.8 -48.91 78.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.846 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 29' ' ' LEU . 47.8 t0 -63.01 -39.23 94.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.548 ' CG1' ' HB3' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -57.37 -44.28 83.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.748 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.61 ' CZ ' ' CE ' ' A' ' 153' ' ' MET . 14.4 m-85 -61.85 -42.13 98.67 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.056 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.542 HG11 ' C ' ' A' ' 35' ' ' SER . 6.6 m -101.29 25.14 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.746 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -56.28 107.59 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.262 -179.642 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.63 6.15 80.73 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.468 ' HB2' ' HB ' ' A' ' 28' ' ' VAL . . . -64.52 139.42 58.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.547 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -64.24 -41.88 96.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.991 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.51 -22.35 17.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.643 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.491 ' O ' HG12 ' A' ' 28' ' ' VAL . . . 88.02 -8.52 77.9 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.627 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 92.1 p -83.44 136.99 34.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.342 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.565 ' HB ' ' O ' ' A' ' 72' ' ' VAL . 97.5 mt -73.45 106.71 3.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.172 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.599 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 32.5 p -102.17 -175.1 2.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.152 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.607 HG23 ' CD1' ' A' ' 61' ' ' ILE . 6.4 p -64.19 -30.32 71.39 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.442 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.6 mmtt -72.58 -50.53 24.84 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.192 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.599 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 20.4 mp0 -69.68 -40.71 76.22 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.296 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.609 HD11 ' SD ' ' A' ' 60' ' ' MET . 8.2 tt -62.32 -51.4 67.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.434 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.475 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.85 -30.34 77.72 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.452 ' NZ ' ' O ' ' A' ' 26' ' ' ILE . 0.0 OUTLIER -54.56 -49.86 69.32 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.768 0.318 . . . . 0.0 110.262 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.64 ' CG2' ' SD ' ' A' ' 47' ' ' MET . 1.3 t -72.94 -30.41 32.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.615 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.1 mmm -59.31 -45.08 92.27 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.587 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 73.4 mtp85 -67.25 -37.49 83.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.64 ' SD ' ' CG2' ' A' ' 44' ' ' VAL . 1.5 ptm -52.9 -30.23 33.02 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.499 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.541 ' CD1' ' HA ' ' A' ' 153' ' ' MET . 16.6 mt -93.31 -5.46 49.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.776 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 105.57 7.42 36.89 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.587 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 58.9 mm-40 -85.44 138.86 31.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.777 0.322 . . . . 0.0 111.038 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.448 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 30.1 t-20 -126.36 59.14 29.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.376 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.538 ' HB2' ' OE2' ' A' ' 56' ' ' GLU . 73.4 Cg_endo -80.19 142.04 14.94 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 C-N-CA 122.718 2.279 . . . . 0.0 112.864 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.548 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 63.6 p -81.16 160.5 65.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.376 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -56.86 -36.82 99.07 Favored 'Trans proline' 0 C--N 1.295 -2.271 0 C-N-CA 122.747 2.298 . . . . 0.0 111.761 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -62.18 -49.47 75.66 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.978 0.418 . . . . 0.0 110.763 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 53' ' ' THR . 1.3 pp20? -72.56 -34.99 67.88 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.646 ' O ' HG13 ' A' ' 61' ' ' ILE . 38.2 mt -65.16 -41.7 94.43 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.584 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.588 ' N ' HG21 ' A' ' 38' ' ' THR . 29.0 tt0 -61.93 -42.22 98.84 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.18 -179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -62.55 -51.8 65.95 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.426 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.609 ' SD ' HD11 ' A' ' 41' ' ' LEU . 2.5 ppp? -58.49 -34.65 71.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.035 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.646 HG13 ' O ' ' A' ' 57' ' ' LEU . 15.5 mt -60.92 -44.57 98.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.082 0.468 . . . . 0.0 110.807 177.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.578 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 34.1 t70 -61.0 -27.43 68.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.854 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -49.4 -38.44 28.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.62 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -111.95 -3.78 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.732 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.608 ' OD2' ' N ' ' A' ' 69' ' ' SER . 51.4 t0 -79.65 104.78 10.48 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.195 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -63.62 -45.59 89.61 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.418 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.573 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 54.6 p30 -91.38 -0.19 57.61 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.839 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.539 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 60.42 29.75 69.92 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.608 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 3.0 p -69.79 -0.02 6.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.839 0.352 . . . . 0.0 110.763 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.572 ' C ' HG22 ' A' ' 61' ' ' ILE . . . 76.77 14.23 82.76 Favored Glycine 0 CA--C 1.521 0.409 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.0 p -139.74 132.51 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.565 ' O ' ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -101.64 110.0 27.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.002 179.173 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.451 ' CG ' ' OE1' ' A' ' 76' ' ' GLU . 55.2 p-10 -78.98 -169.05 1.65 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.227 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.554 ' HE1' ' CD2' ' A' ' 78' ' ' LEU . 1.1 t80 -55.64 -50.09 71.13 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.452 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.449 ' HB3' ' HZ1' ' A' ' 6' ' ' LYS . 98.2 m-20 -62.43 -42.77 99.7 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.118 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.543 ' OE2' ' HA ' ' A' ' 65' ' ' ASP . 25.7 mt-10 -64.81 -42.07 95.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.381 0.61 . . . . 0.0 110.354 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.683 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -69.62 -44.9 69.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.916 179.532 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.628 HD21 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -57.05 -37.21 71.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.599 ' HA ' ' CG1' ' A' ' 82' ' ' VAL . 42.1 t -60.97 -43.25 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.207 178.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.406 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 1.6 ttm -54.48 -42.76 71.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.536 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 14.4 mmt -59.85 -45.45 92.39 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.49 . . . . 0.0 110.282 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.635 HG22 ' CD2' ' A' ' 5' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.434 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.615 HD12 ' SD ' ' A' ' 45' ' ' MET . 11.1 tt . . . . . 0 N--CA 1.461 0.104 0 CA-C-O 120.635 0.255 . . . . 0.0 110.8 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.564 ' C ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -26.88 111.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.635 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.67 -39.49 88.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.483 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.549 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -44.69 -80.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.132 0.492 . . . . 0.0 110.457 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.81 -35.81 77.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.773 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.61 ' CE ' ' CZ ' ' A' ' 27' ' ' PHE . 13.6 ttt -49.94 -51.84 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.885 0.374 . . . . 0.0 110.291 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.539 ' CE ' ' HB1' ' A' ' 23' ' ' ALA . 16.1 mtp -69.43 -32.04 70.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.472 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.549 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.6 mt-30 -59.9 -42.06 93.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.103 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.461 ' HB1' ' CD2' ' A' ' 48' ' ' LEU . . . -63.52 -42.88 98.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.388 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.4 OUTLIER -66.65 -38.04 86.05 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.55 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 154' ' ' MET . 86.9 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.383 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.593 HD13 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.069 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.65 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.1 m-30 -68.65 -33.68 74.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.54 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -56.89 -46.86 81.63 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -62.55 -35.71 80.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -55.66 -40.95 72.96 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.251 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.528 HG21 HD12 ' A' ' 78' ' ' LEU . 68.8 t -63.14 -46.95 94.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.91 -23.3 61.45 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.543 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 84.2 mm-40 -70.43 -35.72 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.658 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.602 HD13 ' CD1' ' A' ' 20' ' ' PHE . 21.9 mt -57.76 126.09 25.85 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.641 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.561 HG23 ' CB ' ' A' ' 16' ' ' GLN . 1.5 t -64.12 175.19 1.31 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.284 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.0 mm-40 -60.88 -43.06 98.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.59 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -71.55 -48.14 50.5 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.561 ' CB ' HG23 ' A' ' 13' ' ' THR . 8.1 tt0 -61.18 -43.86 98.21 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.295 0.569 . . . . 0.0 110.393 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -68.26 -32.23 72.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.63 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.2 t-20 -60.87 -44.24 97.33 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.884 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -60.71 -44.37 96.68 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.129 0.49 . . . . 0.0 109.835 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.653 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 30.6 m-85 -66.76 -38.04 85.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.847 179.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -60.25 -40.11 89.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.074 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.79 -42.02 92.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.741 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.594 ' O ' ' HD1' ' A' ' 27' ' ' PHE . . . -62.21 -40.29 95.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.574 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 16.8 t80 -57.64 -49.17 77.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.787 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 29' ' ' LEU . 36.1 t70 -63.49 -40.16 96.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.606 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.567 ' O ' ' NZ ' ' A' ' 43' ' ' LYS . 0.6 OUTLIER -57.81 -44.02 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.584 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.631 ' CE1' ' HE2' ' A' ' 153' ' ' MET . 17.4 m-85 -61.71 -43.12 99.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.738 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.528 HG12 ' O ' ' A' ' 35' ' ' SER . 28.0 m -102.9 26.96 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.562 ' HB3' ' NZ ' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -57.49 105.67 0.26 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.376 -179.722 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 3.4 67.82 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.464 ' HB2' ' HA2' ' A' ' 34' ' ' GLY . . . -63.44 136.44 57.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.289 . . . . 0.0 110.368 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -61.81 -44.79 96.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.544 ' OD1' ' O ' ' A' ' 33' ' ' ASP . 64.6 t0 -92.43 -22.37 19.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 31' ' ' ALA . . . 88.51 -8.04 80.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.548 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 59.5 p -81.15 137.52 35.93 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.631 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 72' ' ' VAL . 96.6 mt -74.19 105.8 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.056 0.455 . . . . 0.0 110.974 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.594 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 4.8 p -102.45 -172.49 2.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.693 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.581 HG21 ' C ' ' A' ' 57' ' ' LEU . 16.3 p -60.88 -37.18 81.27 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.437 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -69.93 -49.18 54.53 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.337 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.594 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 46.9 mp0 -64.35 -42.9 96.0 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.638 ' O ' ' HG2' ' A' ' 45' ' ' MET . 0.5 OUTLIER -64.06 -48.54 75.83 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.89 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.48 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.2 -37.55 94.71 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.581 -1.008 . . . . 0.0 110.581 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.567 ' NZ ' ' O ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -50.37 -63.45 1.12 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 109.851 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.653 ' O ' ' CD2' ' A' ' 48' ' ' LEU . 13.2 t -59.45 -36.29 63.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.638 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 77.8 mmm -55.35 -39.5 70.12 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.646 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 10.4 mtm105 -66.68 -32.85 74.42 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.539 ' HE3' ' HA ' ' A' ' 44' ' ' VAL . 32.6 mtm -59.18 -37.43 77.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.653 ' CD2' ' O ' ' A' ' 44' ' ' VAL . 2.3 mm? -83.76 -5.33 59.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.623 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.37 11.22 34.14 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.646 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -91.25 138.74 31.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.154 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.44 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 34.6 p30 -127.24 57.75 25.75 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.892 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.515 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 68.9 Cg_endo -78.47 150.4 25.02 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.711 2.274 . . . . 0.0 112.56 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.7 p -89.96 156.51 46.78 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.597 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.463 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 52.3 Cg_exo -55.6 -40.26 86.35 Favored 'Trans proline' 0 C--N 1.301 -1.935 0 C-N-CA 122.762 2.308 . . . . 0.0 111.909 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -61.3 -49.65 76.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.497 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.458 ' O ' ' SD ' ' A' ' 60' ' ' MET . 78.7 mm-40 -69.37 -38.99 78.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.18 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.581 ' C ' HG21 ' A' ' 38' ' ' THR . 26.3 mt -60.25 -28.43 68.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.698 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.432 ' N ' HG21 ' A' ' 38' ' ' THR . 39.5 tt0 -58.87 -40.02 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.126 -179.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -63.49 -47.85 80.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.631 0.729 . . . . 0.0 110.779 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.533 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.17 -38.9 90.85 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.914 179.698 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.538 HG21 ' O ' ' A' ' 70' ' ' GLY . 17.3 mm -62.36 -45.56 98.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.362 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.594 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.0 t70 -64.26 -23.14 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.807 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -53.66 -41.08 66.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.572 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.516 HG11 ' CB ' ' A' ' 80' ' ' MET . 0.9 OUTLIER -114.68 -3.52 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.4 . . . . 0.0 110.718 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.594 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 63.5 t0 -88.16 88.67 7.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -71.88 -26.74 62.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.924 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.56 -11.46 60.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.967 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.04 21.73 64.06 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.019 -0.833 . . . . 0.0 111.019 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 p -85.93 0.7 52.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.887 0.375 . . . . 0.0 110.747 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.538 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 72.69 15.51 77.84 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.548 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 9.8 p -139.43 126.9 21.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.903 0.382 . . . . 0.0 110.657 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.6 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 0.2 OUTLIER -91.37 107.72 19.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.348 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.463 ' OD1' ' CG ' ' A' ' 76' ' ' GLU . 52.3 p-10 -74.34 -169.08 0.75 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.508 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.592 ' HD1' ' CE2' ' A' ' 77' ' ' PHE . 1.8 t80 -57.41 -50.69 72.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 -179.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -62.93 -41.92 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.816 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.6 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 30.8 mt-10 -64.87 -43.26 93.52 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.189 0.519 . . . . 0.0 110.381 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.653 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -68.88 -39.76 79.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.443 0.639 . . . . 0.0 109.724 179.739 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.587 HD23 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -60.38 -37.03 79.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.431 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.685 ' O ' HG13 ' A' ' 82' ' ' VAL . 28.3 t -61.88 -42.28 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.967 178.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.568 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 2.6 ptp -56.48 -38.54 71.87 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.878 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.495 ' CE ' ' HE3' ' A' ' 153' ' ' MET . 21.1 mmt -62.42 -47.76 82.67 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.685 HG13 ' O ' ' A' ' 79' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.502 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.292 179.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 148' ' ' ILE . 5.4 tp . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.747 0.308 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.61 ' O ' ' CB ' ' A' ' 153' ' ' MET . 29.6 m -71.87 88.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.986 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.552 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.62 -31.95 69.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.834 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -53.02 -48.69 67.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.038 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.408 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -107.56 -18.98 13.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.954 0.407 . . . . 0.0 111.064 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.631 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -57.12 -45.98 83.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.226 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.561 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 mtp -70.01 -29.82 66.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.577 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.408 ' OE1' ' HA ' ' A' ' 152' ' ' ALA . 82.3 mt-30 -62.05 -39.61 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.449 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.474 ' HB1' HD12 ' A' ' 48' ' ' LEU . . . -62.27 -25.27 67.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.781 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.601 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.1 OUTLIER -97.13 -51.97 4.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.756 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.6 mt . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.543 -179.953 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.627 HD12 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.65 ' CD2' HG22 ' A' ' 82' ' ' VAL . 20.9 m-30 -69.2 -31.89 70.8 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.53 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.76 -45.37 89.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.05 -34.15 76.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.569 ' HB1' ' O ' ' A' ' 5' ' ' TYR . . . -58.39 -42.01 86.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.758 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.583 ' O ' ' HE2' ' A' ' 17' ' ' LYS . 95.4 t -63.71 -43.95 98.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -68.58 -24.3 64.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.522 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -71.15 -35.4 71.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.691 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.628 HD13 ' CD1' ' A' ' 20' ' ' PHE . 17.2 mt -64.5 107.8 1.48 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.277 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.609 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -51.21 -179.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.649 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.538 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 76.5 mm-40 -60.92 -44.77 96.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.981 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -70.92 -45.7 63.8 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.95 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.609 ' H ' HG23 ' A' ' 13' ' ' THR . 29.5 tt0 -63.66 -44.34 94.08 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.178 0.514 . . . . 0.0 110.127 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.583 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.6 ttmt -70.44 -30.83 67.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.589 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.538 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 63.0 t30 -60.33 -44.46 95.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.106 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.41 -45.44 93.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.106 0.479 . . . . 0.0 109.947 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.657 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 28.4 m-85 -65.11 -39.01 92.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.198 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -60.53 -39.51 88.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.836 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.485 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.53 -42.22 96.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.852 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB3' HD13 ' A' ' 157' ' ' LEU . . . -61.66 -39.41 91.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.181 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.642 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 17.2 t80 -57.27 -48.63 78.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.638 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.587 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.75 -39.55 94.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.527 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.589 HG22 ' CG2' ' A' ' 44' ' ' VAL . 0.6 OUTLIER -56.65 -45.88 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.528 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CE1' HG11 ' A' ' 44' ' ' VAL . 22.6 m-85 -62.03 -41.99 98.69 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.365 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.518 HG13 ' O ' ' A' ' 35' ' ' SER . 15.7 m -101.57 21.36 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.427 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -53.12 112.47 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.325 -179.825 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.32 -9.07 78.35 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.15 127.03 29.38 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.247 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.11 -41.39 97.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.56 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.5 p30 -81.36 -22.38 38.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.874 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.56 ' N ' ' OD1' ' A' ' 33' ' ' ASP . . . 78.73 -2.5 68.01 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.57 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 57.6 p -90.6 136.93 32.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.62 ' HB ' HG11 ' A' ' 72' ' ' VAL . 96.7 mt -73.6 106.22 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.662 -0.415 . . . . 0.0 111.358 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.585 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 56.1 p -101.94 161.65 13.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.798 179.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.734 ' N ' HD13 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -41.66 -35.58 0.79 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.611 -179.339 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -49.54 57.31 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.588 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 3.4 mp0 -67.18 -40.06 86.51 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 45' ' ' MET . 6.6 tt -60.06 -50.44 73.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.44 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.48 ' CA ' HD12 ' A' ' 57' ' ' LEU . . . -64.93 -35.74 92.26 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.5 -60.98 2.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.22 0.534 . . . . 0.0 109.947 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.658 ' O ' ' CD2' ' A' ' 48' ' ' LEU . 25.5 t -61.06 -38.93 80.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 177.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.599 ' HB3' ' HB2' ' A' ' 50' ' ' GLN . 88.8 mmm -54.46 -41.6 69.67 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.626 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 71.6 mtp180 -65.01 -32.65 74.49 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.563 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 33.1 mtm -58.7 -37.3 75.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.658 ' CD2' ' O ' ' A' ' 44' ' ' VAL . 2.1 mm? -85.76 0.01 54.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.516 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.36 5.45 57.01 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.626 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 5.8 mm-40 -80.53 138.49 36.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.961 0.41 . . . . 0.0 110.955 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.454 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 26.6 p-10 -128.54 56.79 24.28 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.309 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG3' ' HE1' ' A' ' 45' ' ' MET . 64.0 Cg_endo -77.67 139.86 18.27 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.721 2.281 . . . . 0.0 112.864 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.6 p -78.6 158.16 76.29 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.47 -35.21 84.57 Favored 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.726 2.284 . . . . 0.0 111.824 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -61.02 -51.6 68.53 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.21 0.529 . . . . 0.0 110.387 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.579 ' O ' ' CE ' ' A' ' 60' ' ' MET . 72.9 mt-10 -69.64 -39.89 76.84 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.327 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.486 HD23 ' CD2' ' A' ' 41' ' ' LEU . 43.4 mt -61.48 -37.75 84.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.678 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.52 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 50.6 tt0 -59.8 -41.36 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.733 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -62.85 -41.86 99.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.255 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.579 ' CE ' ' O ' ' A' ' 56' ' ' GLU . 4.4 mmt -62.57 -39.09 92.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.734 HD13 ' N ' ' A' ' 38' ' ' THR . 2.8 mt -61.65 -45.7 98.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.459 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 14.9 t70 -60.14 -36.08 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.565 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -45.98 -38.91 8.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.157 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 80' ' ' MET . 0.6 OUTLIER -113.88 -10.11 12.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.555 ' OD1' ' OG ' ' A' ' 69' ' ' SER . 16.0 t70 -96.65 67.37 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.323 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -67.71 -17.62 64.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.793 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.466 ' OD1' ' OD2' ' A' ' 65' ' ' ASP . 49.6 p-10 -75.93 -10.3 59.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.496 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.68 14.45 75.26 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.555 ' OG ' ' OD1' ' A' ' 65' ' ' ASP . 88.1 p -71.86 -16.84 62.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.617 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.97 17.04 78.34 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.578 ' CG2' ' HB3' ' A' ' 37' ' ' SER . 0.2 OUTLIER -149.2 119.43 7.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.924 0.392 . . . . 0.0 110.76 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.62 HG11 ' HB ' ' A' ' 36' ' ' ILE . 0.1 OUTLIER -85.99 110.38 19.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.44 179.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.536 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -81.49 -162.29 0.5 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.56 ' HD1' ' CE2' ' A' ' 77' ' ' PHE . 1.9 t80 -56.72 -49.52 74.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.775 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -44.96 85.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.644 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.536 ' HB2' ' N ' ' A' ' 73' ' ' ASP . 53.2 mt-10 -62.69 -41.37 99.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.321 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.657 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -71.04 -44.34 66.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.186 0.517 . . . . 0.0 109.634 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.651 HD23 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -56.1 -37.33 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.619 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.651 ' O ' HG12 ' A' ' 82' ' ' VAL . 42.6 t -63.84 -41.73 93.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.037 178.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.716 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -54.25 -38.34 65.68 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.204 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.716 ' N ' ' HG2' ' A' ' 80' ' ' MET . 12.7 mmt -65.36 -48.25 73.61 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 121.255 0.55 . . . . 0.0 110.848 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 79' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.613 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.495 HG22 ' O ' ' A' ' 148' ' ' ILE . 12.6 tt . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.743 0.306 . . . . 0.0 110.485 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.576 ' O ' ' CB ' ' A' ' 153' ' ' MET . 3.4 m -70.19 103.73 2.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.387 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.474 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.85 -38.81 83.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.341 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -45.02 -82.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.458 ' H ' ' HB2' ' A' ' 151' ' ' ASP . . . -60.41 -35.2 75.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.805 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.603 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 9.5 ttt -49.74 -52.41 31.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.245 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.48 ' HE1' ' HB3' ' A' ' 23' ' ' ALA . 10.7 mtp -71.1 -29.21 64.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.481 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.603 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 52.7 mt-30 -60.3 -44.09 95.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.345 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.507 ' HB3' HD12 ' A' ' 48' ' ' LEU . . . -63.54 -42.81 98.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.077 0.465 . . . . 0.0 110.17 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.2 OUTLIER -64.37 -42.13 96.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.642 -179.533 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.405 -179.826 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.571 HG21 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.283 0 CA-C-O 121.025 0.44 . . . . 0.0 109.982 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.668 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.2 m-30 -69.95 -34.0 72.85 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.602 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -54.9 -45.61 74.74 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.302 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 11' ' ' GLN . . . -65.1 -33.27 75.63 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.578 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.84 -40.27 83.75 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.581 HG23 HD13 ' A' ' 78' ' ' LEU . 95.1 t -61.98 -46.13 97.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.046 0.45 . . . . 0.0 109.788 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -73.42 -23.78 60.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 7' ' ' ALA . 3.1 mm-40 -72.03 -38.6 69.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.779 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.607 HD11 ' CD1' ' A' ' 20' ' ' PHE . 21.5 mt -49.4 118.72 2.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.734 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.556 HG21 ' HB2' ' A' ' 16' ' ' GLN . 8.8 t -56.33 -177.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.374 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.53 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 88.0 tt0 -60.04 -44.01 94.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -74.0 -51.23 16.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.556 ' HB2' HG21 ' A' ' 13' ' ' THR . 13.0 mt-30 -50.47 -52.76 35.23 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.591 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.0 ttmt -66.18 -35.06 79.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.046 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 62.2 t30 -59.6 -43.77 93.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.199 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.5 ' O ' ' HE3' ' A' ' 154' ' ' MET . 12.6 mt-10 -61.02 -46.92 88.78 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.196 0.522 . . . . 0.0 110.492 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.64 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 67.4 m-85 -66.15 -38.54 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.224 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -56.5 -42.58 78.57 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.564 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.77 -40.86 94.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.915 178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.529 ' HA ' HD12 ' A' ' 26' ' ' ILE . . . -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.185 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.612 ' HB2' ' CE2' ' A' ' 77' ' ' PHE . 15.9 t80 -57.32 -48.23 79.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.444 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.609 ' O ' ' N ' ' A' ' 29' ' ' LEU . 64.6 t0 -62.23 -40.02 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.393 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.564 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.33 -46.35 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.75 179.674 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.646 ' CZ ' ' HE2' ' A' ' 153' ' ' MET . 12.9 m-85 -60.66 -41.32 94.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.459 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.557 HG13 ' O ' ' A' ' 35' ' ' SER . 25.1 m -107.22 25.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.619 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.609 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -56.97 105.93 0.26 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.305 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.49 -9.32 58.94 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 28' ' ' VAL . . . -64.14 129.76 41.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.806 0.336 . . . . 0.0 110.517 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.63 -43.85 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.779 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 50.2 p30 -80.09 -23.36 41.33 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.834 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.6 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 79.68 1.81 87.32 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.627 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 75.4 p -90.98 135.67 33.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.625 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.599 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -77.6 110.46 13.31 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.101 -179.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.57 ' C ' HD12 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -108.86 -178.58 3.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.05 178.918 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.606 ' N ' HD12 ' A' ' 61' ' ' ILE . 2.8 p -58.58 -24.23 60.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.516 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -84.46 -48.37 9.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.229 178.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.677 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 60.3 mp0 -71.96 -20.81 61.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.581 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.57 ' O ' ' HG2' ' A' ' 45' ' ' MET . 10.0 tt -83.2 -49.28 9.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.951 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.552 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -60.15 -38.08 93.87 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.677 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.41 -58.22 4.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.731 0.3 . . . . 0.0 110.305 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.595 HG12 ' CE1' ' A' ' 27' ' ' PHE . 3.0 t -62.85 -32.09 54.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 89.6 mmm -60.19 -42.61 95.43 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.695 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 40.1 mtp180 -67.45 -32.04 72.63 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.453 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 26.8 mtm -59.53 -36.65 76.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.881 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.55 HD23 ' HB3' ' A' ' 156' ' ' ALA . 73.4 mt -88.59 -0.79 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.314 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.6 4.15 52.54 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.695 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 25.2 mm100 -90.34 135.27 33.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.972 0.415 . . . . 0.0 110.574 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.557 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 34.1 t-20 -134.11 60.99 48.29 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.544 ' HG2' ' CD2' ' A' ' 57' ' ' LEU . 60.2 Cg_endo -75.46 149.14 34.48 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.684 2.256 . . . . 0.0 112.41 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.623 ' OG1' ' OE1' ' A' ' 56' ' ' GLU . 62.6 p -81.64 161.68 60.65 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.056 0.455 . . . . 0.0 110.623 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -54.63 -39.36 89.14 Favored 'Trans proline' 0 C--N 1.303 -1.821 0 C-N-CA 122.71 2.273 . . . . 0.0 111.837 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -62.77 -50.49 70.85 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.154 0.502 . . . . 0.0 110.827 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.623 ' OE1' ' OG1' ' A' ' 53' ' ' THR . 21.9 mp0 -67.94 -39.68 83.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.841 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.708 ' HA ' ' SD ' ' A' ' 60' ' ' MET . 23.0 mt -62.09 -39.37 92.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.754 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.477 ' N ' HG23 ' A' ' 38' ' ' THR . 5.7 tt0 -59.43 -40.66 87.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.34 -49.33 76.01 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.026 0.441 . . . . 0.0 111.203 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.708 ' SD ' ' HA ' ' A' ' 57' ' ' LEU . 2.3 ptp -64.74 -35.16 80.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.489 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.614 HG13 ' O ' ' A' ' 57' ' ' LEU . 1.1 mt -62.63 -46.61 95.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.075 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.488 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 13.2 t70 -61.45 -30.22 70.44 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -47.1 -37.14 9.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.283 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.467 HG12 HG11 ' A' ' 79' ' ' VAL . 1.5 m -114.52 -16.3 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.662 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.557 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 38.8 t70 -88.25 78.31 8.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.47 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -72.77 -11.65 60.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.782 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.53 -12.13 60.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.532 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.29 14.07 68.38 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 85.7 p -85.1 -6.41 59.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 110.713 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.523 ' O ' HG23 ' A' ' 61' ' ' ILE . . . 71.51 17.88 76.66 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 0.9 OUTLIER -138.45 124.12 19.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.934 0.397 . . . . 0.0 110.76 -179.636 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.599 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -90.12 117.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.421 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.524 ' OD1' ' HG3' ' A' ' 76' ' ' GLU . 45.3 p-10 -82.26 -168.12 1.85 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.609 179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.6 ' C ' ' CD1' ' A' ' 74' ' ' PHE . 1.0 OUTLIER -56.84 -51.06 70.48 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.714 -179.521 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.67 -42.59 95.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.899 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.587 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 46.4 mt-10 -64.49 -42.05 96.09 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.109 0.48 . . . . 0.0 110.575 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.64 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -70.29 -43.19 70.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.797 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.616 HD22 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -52.92 -37.79 61.15 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.622 ' O ' HG11 ' A' ' 82' ' ' VAL . 39.7 t -61.56 -45.87 97.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.162 0.506 . . . . 0.0 110.42 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.692 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -53.6 -36.88 62.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.305 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.692 ' N ' ' HG2' ' A' ' 80' ' ' MET . 24.7 mmt -66.55 -50.0 64.6 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.198 0.523 . . . . 0.0 110.494 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.668 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.62 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.306 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 48' ' ' LEU . 18.7 tt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.727 0.299 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' SER . . . . . 0.65 ' O ' ' CB ' ' A' ' 153' ' ' MET . 68.4 m -67.37 92.91 0.3 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.254 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -50.04 -34.09 20.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.514 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.527 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -62.17 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.229 0.537 . . . . 0.0 110.891 179.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -60.46 -30.92 69.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.554 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' MET . . . . . 0.65 ' CB ' ' O ' ' A' ' 149' ' ' SER . 2.3 ttt -50.96 -54.5 23.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.652 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' MET . . . . . 0.5 ' HE3' ' O ' ' A' ' 19' ' ' GLU . 1.9 mtp -65.77 -31.84 73.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.193 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.527 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.3 mt-30 -60.69 -41.47 95.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.882 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . 0.55 ' HB3' HD23 ' A' ' 48' ' ' LEU . . . -63.57 -39.89 95.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.095 0.474 . . . . 0.0 110.267 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -71.6 -48.08 50.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.27 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.406 HD21 ' HB1' ' A' ' 22' ' ' ALA . 91.9 mt . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.777 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.598 ' N ' ' OE1' ' A' ' 66' ' ' GLU . 2.1 tpt . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.45 129.1 39.55 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.287 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 68.8 m-20 -70.08 -38.65 75.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.701 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.603 HD13 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -58.09 -44.03 86.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.405 -0.518 . . . . 0.0 109.796 -179.656 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.644 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.0 m-30 -72.9 -29.33 63.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.606 178.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.534 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -59.02 -46.49 88.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.579 -0.896 . . . . 0.0 108.579 179.305 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.92 81.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.455 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.67 -40.88 80.39 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.6 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.581 HG23 ' HB3' ' A' ' 78' ' ' LEU . 75.4 t -62.48 -47.3 93.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.626 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.64 -24.76 66.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.648 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -70.47 -36.32 73.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.045 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.574 HD13 ' CD1' ' A' ' 20' ' ' PHE . 57.6 mt -58.53 127.9 34.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.266 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.531 HG22 ' CB ' ' A' ' 16' ' ' GLN . 4.4 t -61.87 171.37 1.68 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -60.69 -39.98 90.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.17 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -48.81 45.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.531 ' CB ' HG22 ' A' ' 13' ' ' THR . 64.5 tt0 -62.61 -42.73 99.75 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.132 0.492 . . . . 0.0 110.585 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.519 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 32.3 ttmt -66.81 -35.24 79.61 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.689 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -59.34 -44.07 92.69 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.488 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -61.84 -44.78 96.14 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.402 0.62 . . . . 0.0 109.957 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.673 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 14.1 m-30 -64.45 -38.66 91.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.766 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 24' ' ' PHE . 24.7 tptm -59.09 -39.76 83.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.88 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.62 93.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.508 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.54 -38.53 87.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.01 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.627 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 17.3 t80 -56.57 -49.56 74.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.607 ' O ' ' N ' ' A' ' 29' ' ' LEU . 61.6 t0 -62.27 -39.23 92.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.263 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.533 ' CG2' HG22 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -56.4 -44.48 80.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.669 179.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.635 ' CZ ' ' CE ' ' A' ' 153' ' ' MET . 16.8 m-85 -62.17 -42.71 99.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.375 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.564 ' O ' ' N ' ' A' ' 31' ' ' ALA . 6.2 m -97.51 11.37 5.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.741 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.607 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -42.03 108.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.06 12.74 58.57 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.564 ' N ' ' O ' ' A' ' 28' ' ' VAL . . . -83.9 128.76 34.77 Favored 'General case' 0 C--N 1.331 -0.239 0 O-C-N 122.777 -0.249 . . . . 0.0 110.555 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -64.18 -40.73 96.72 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.701 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.491 ' OD2' ' OG ' ' A' ' 35' ' ' SER . 0.5 OUTLIER -86.9 -21.96 25.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.565 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 81.35 -1.23 86.11 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.585 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 55.6 p -86.16 135.46 33.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.556 ' HB ' HG11 ' A' ' 72' ' ' VAL . 89.6 mt -76.87 105.65 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.106 0.479 . . . . 0.0 110.709 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.524 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 60.3 p -103.33 177.49 4.83 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.579 HG22 ' N ' ' A' ' 58' ' ' GLN . 6.9 p -53.32 -39.59 64.15 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.043 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -66.47 -44.44 82.71 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.634 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 71.1 mm-40 -73.53 -20.69 60.58 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 109.956 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.588 HD23 ' H8 ' ' A' ' 201' ' ' V8Y . 0.4 OUTLIER -81.82 -47.37 12.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.54 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.501 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -60.94 -37.94 94.63 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.369 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.634 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -48.69 -57.29 6.51 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.203 0.502 . . . . 0.0 110.276 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.574 HG12 ' CE1' ' A' ' 27' ' ' PHE . 11.8 t -63.67 -35.63 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 CA-C-O 121.097 0.475 . . . . 0.0 110.019 177.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.588 ' SD ' HD11 ' A' ' 148' ' ' ILE . 87.5 mmm -59.06 -41.58 88.26 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.619 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 76.5 mtp85 -66.42 -33.16 75.08 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.556 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 20.5 mtm -59.75 -38.28 81.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.969 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 153' ' ' MET . 79.3 mt -84.19 -1.87 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.857 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.41 8.77 52.25 Favored Glycine 0 CA--C 1.529 0.906 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.619 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 87.0 mm-40 -90.83 138.08 31.86 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.855 0.36 . . . . 0.0 111.078 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.466 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 21.0 t-20 -127.38 60.89 46.1 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.81 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.527 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 81.7 Cg_endo -79.32 139.89 15.02 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.573 2.182 . . . . 0.0 112.169 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.422 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 73.8 p -74.25 152.31 88.09 Favored Pre-proline 0 CA--C 1.516 -0.34 0 CA-C-O 121.037 0.446 . . . . 0.0 110.323 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.13 -43.06 60.0 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 122.722 2.281 . . . . 0.0 112.294 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -62.74 -40.28 96.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.168 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.422 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 0.9 OUTLIER -78.84 -31.89 45.88 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.552 ' C ' HG21 ' A' ' 38' ' ' THR . 3.1 mt -60.96 -26.27 67.42 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.16 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.579 ' N ' HG22 ' A' ' 38' ' ' THR . 37.7 tt0 -58.93 -37.74 77.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.723 -178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -61.58 -41.28 97.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.158 0.504 . . . . 0.0 110.804 178.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.454 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 3.6 mmt -64.51 -42.02 96.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.763 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.525 HG22 ' O ' ' A' ' 70' ' ' GLY . 10.2 mm -61.62 -44.56 98.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.696 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.491 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 66.0 t0 -59.79 -29.91 68.53 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.33 -42.88 10.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.972 0.415 . . . . 0.0 110.338 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.468 HG11 ' HB2' ' A' ' 80' ' ' MET . 0.3 OUTLIER -113.2 -12.34 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.267 179.677 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.507 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 30.7 t70 -91.98 63.24 4.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.399 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.598 ' OE1' ' N ' ' A' ' 1' ' ' MET . 85.2 tt0 -65.21 -21.0 66.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.821 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.413 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 58.7 p-10 -74.67 -8.48 56.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.896 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.74 15.17 75.69 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.4 m -66.21 -26.74 67.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.927 0.394 . . . . 0.0 110.405 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.525 ' O ' HG22 ' A' ' 61' ' ' ILE . . . 86.41 -1.14 87.34 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.585 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 25.6 p -136.44 133.77 36.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.922 0.391 . . . . 0.0 110.926 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.556 HG11 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -100.48 103.82 15.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.217 0.532 . . . . 0.0 109.972 179.212 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.524 ' OD1' ' HA ' ' A' ' 35' ' ' SER . 18.1 m-20 -72.27 -163.9 0.13 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.302 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.615 ' HE1' ' CD2' ' A' ' 78' ' ' LEU . 1.4 t80 -57.86 -49.88 75.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.004 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -62.99 -42.29 99.8 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.017 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.523 ' CD ' ' HA ' ' A' ' 72' ' ' VAL . 45.5 mt-10 -64.38 -42.09 96.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.385 0.612 . . . . 0.0 111.132 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.673 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -71.33 -41.13 70.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.999 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.615 ' CD2' ' HE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -58.39 -37.22 74.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.846 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.605 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 42.1 t -60.69 -42.53 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 N-CA-C 109.335 -0.616 . . . . 0.0 109.335 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.482 ' HA ' ' HD3' ' A' ' 83' ' ' ARG . 1.0 OUTLIER -53.27 -43.53 67.5 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.916 -0.714 . . . . 0.0 110.083 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.654 ' O ' ' SD ' ' A' ' 85' ' ' MET . 24.7 mmt -60.83 -45.27 95.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.762 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.688 ' HA ' ' HB2' ' A' ' 85' ' ' MET . 0.2 OUTLIER -74.79 -27.33 20.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.672 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' A' ' 79' ' ' VAL . 76.7 mtp85 -60.57 -42.56 96.92 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.609 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 55.5 m -92.85 -15.27 26.66 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.532 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.688 ' HB2' ' HA ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -70.79 -48.14 55.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.208 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -94.16 -8.16 40.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.608 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.568 ' CB ' ' O ' ' A' ' 83' ' ' ARG . 66.3 t0 -93.46 97.09 10.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.308 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.607 ' OD1' ' N ' ' A' ' 89' ' ' SER . 5.0 p30 -68.44 -38.76 81.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.567 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.607 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 22.0 t 179.06 71.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.563 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.405 ' C ' ' HD3' ' A' ' 90' ' ' LYS . 9.7 tmtt? -144.33 134.35 24.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.526 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -150.65 163.82 29.72 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.626 ' O ' ' CD1' ' A' ' 138' ' ' PHE . 5.7 ptmm? -61.3 -23.77 65.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.817 0.342 . . . . 0.0 110.608 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.626 ' CD1' ' O ' ' A' ' 137' ' ' LYS . 1.1 m-85 178.57 -87.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.578 ' O ' ' O ' ' A' ' 140' ' ' ARG . 10.8 mmmm 49.86 30.44 3.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.61 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.578 ' O ' ' O ' ' A' ' 139' ' ' LYS . 8.6 ptp180 44.14 177.44 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.298 0.57 . . . . 0.0 110.951 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.608 ' O ' ' CB ' ' A' ' 142' ' ' THR . 6.3 Cg_exo -73.18 171.82 16.83 Favored 'Trans proline' 0 C--N 1.302 -1.901 0 C-N-CA 123.831 3.021 . . . . 0.0 111.48 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.608 ' CB ' ' O ' ' A' ' 141' ' ' PRO . 0.7 OUTLIER 92.31 112.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.093 0.473 . . . . 0.0 111.017 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.608 ' O ' ' N ' ' A' ' 145' ' ' ARG . 24.5 mt 36.26 63.21 0.64 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.447 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -54.91 76.82 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.956 0.408 . . . . 0.0 110.7 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.608 ' N ' ' O ' ' A' ' 143' ' ' LEU . 37.9 ttm-85 -176.49 -50.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.496 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . 0.578 ' C ' ' O ' ' A' ' 145' ' ' ARG . 0.0 OUTLIER 18.37 52.99 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.719 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER -103.85 142.78 33.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.646 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.601 HG22 ' SD ' ' A' ' 153' ' ' MET . 20.8 tt -39.68 111.61 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.921 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.635 ' O ' ' CB ' ' A' ' 153' ' ' MET . 66.3 m -42.21 96.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 148' ' ' ILE . . . -60.1 -39.1 84.99 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.326 0.391 . . . . 0.0 111.225 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.548 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 40.9 m-20 -50.88 -77.53 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.508 0.67 . . . . 0.0 110.811 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.6 -35.92 81.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.199 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.635 ' CE ' ' CZ ' ' A' ' 27' ' ' PHE . 9.6 ttt -48.49 -53.78 16.73 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.382 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.508 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 2.0 mtp -65.93 -34.0 77.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.09 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.548 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 75.7 mt-30 -59.28 -43.28 92.53 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.62 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.427 ' HB3' ' CD2' ' A' ' 48' ' ' LEU . . . -63.32 -43.97 96.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -63.66 -41.02 98.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.482 -179.156 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.468 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 92.4 mt -88.24 -5.99 58.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.545 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . 0.596 ' O ' ' CD2' ' A' ' 167' ' ' HIS . . . 62.37 36.36 92.99 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.418 ' CB ' ' O ' ' A' ' 159' ' ' GLY . . . 75.79 76.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 110.546 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.603 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 75.7 ttt180 -104.31 90.4 3.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.577 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.603 ' CB ' ' O ' ' A' ' 161' ' ' ARG . . . 149.86 57.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.494 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . 0.413 ' HB3' ' H ' ' A' ' 164' ' ' GLY . 16.0 mttp 61.22 -157.53 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.69 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . 0.413 ' H ' ' HB3' ' A' ' 163' ' ' LYS . . . 72.4 -149.75 44.23 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -41.52 155.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.753 0.311 . . . . 0.0 110.176 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.532 ' O ' ' CD2' ' A' ' 167' ' ' HIS . 71.8 m80 -60.8 -38.2 84.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.088 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . 0.596 ' CD2' ' O ' ' A' ' 159' ' ' GLY . 0.2 OUTLIER 171.52 -94.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.389 179.6 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 31.5 p80 -158.71 163.18 37.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.513 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . 0.552 ' ND1' ' O ' ' A' ' 170' ' ' HIS . 59.6 t-80 -133.49 129.04 36.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.583 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . 0.552 ' O ' ' ND1' ' A' ' 169' ' ' HIS . 96.4 m-70 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.596 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.588 ' H8 ' HD23 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.535 ' CE ' HG22 ' A' ' 79' ' ' VAL . 28.8 mtp . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -66.99 108.65 2.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.092 0.473 . . . . 0.0 110.533 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.531 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 70.3 m-20 -61.54 -40.15 93.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.166 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.586 HD11 ' CE2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -55.07 -48.28 76.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.293 0.568 . . . . 0.0 109.855 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.649 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 21.6 m-30 -71.01 -29.05 64.89 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.603 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 1.4 mmpt? -58.93 -43.79 91.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.551 0.691 . . . . 0.0 109.282 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.63 -34.17 77.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.157 177.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.95 -41.41 82.77 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.611 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.529 HG21 ' CD1' ' A' ' 78' ' ' LEU . 72.2 t -62.24 -45.76 98.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.119 0.485 . . . . 0.0 109.705 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -70.06 -23.07 63.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.642 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.44 -33.74 67.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.536 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.496 HD13 ' CE1' ' A' ' 20' ' ' PHE . 13.9 mt -62.46 129.42 40.56 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.334 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.583 HG22 ' H ' ' A' ' 16' ' ' GLN . 2.6 t -69.64 -179.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.193 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 79.0 mm-40 -60.85 -45.03 96.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.138 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.85 -49.63 56.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.952 0.406 . . . . 0.0 111.454 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.583 ' H ' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -57.43 -51.31 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.273 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.65 -35.28 79.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.883 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.539 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.9 t-20 -60.04 -43.36 95.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.111 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.6 ' O ' ' HE3' ' A' ' 154' ' ' MET . 17.0 mt-10 -60.0 -51.06 71.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.353 179.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.667 ' CD2' ' SD ' ' A' ' 154' ' ' MET . 42.2 m-85 -62.69 -36.2 82.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.751 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.62 -41.3 85.6 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.423 ' O ' HD11 ' A' ' 26' ' ' ILE . . . -60.67 -42.29 96.78 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.845 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB3' ' HE3' ' A' ' 154' ' ' MET . . . -61.76 -39.14 90.58 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.041 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.595 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 10.0 t80 -55.9 -49.75 72.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.391 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.419 ' O ' ' N ' ' A' ' 29' ' ' LEU . 38.7 t70 -62.45 -41.42 98.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.603 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.549 HD13 ' O ' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -59.96 -42.45 89.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.291 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.646 ' CE1' HG13 ' A' ' 44' ' ' VAL . 5.6 m-85 -61.08 -39.42 89.85 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.33 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.554 HG12 ' O ' ' A' ' 35' ' ' SER . 6.8 m -105.18 24.6 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.597 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -54.72 105.85 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.151 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.03 3.16 59.13 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.479 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -69.37 134.48 49.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 110.46 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -67.84 -42.03 82.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.526 ' O ' ' OD1' ' A' ' 33' ' ' ASP . 67.5 t0 -92.13 -20.83 20.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.389 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.516 ' O ' HG13 ' A' ' 28' ' ' VAL . . . 88.48 -8.3 79.34 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.581 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.8 p -78.13 137.08 38.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.359 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.572 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.9 mt -75.82 107.86 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.893 0.378 . . . . 0.0 111.189 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.616 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 24.3 p -101.28 175.19 5.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.828 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.622 ' N ' HD13 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -55.66 -35.79 66.35 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.363 -179.393 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -71.86 -46.28 58.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.244 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.641 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 33.1 mp0 -72.42 -20.93 61.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.826 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.544 ' O ' ' HG2' ' A' ' 45' ' ' MET . 1.1 tt -82.49 -48.97 10.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.932 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.544 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.57 -37.4 94.67 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.641 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.17 -57.53 4.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.376 -0.485 . . . . 0.0 110.121 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.646 HG13 ' CE1' ' A' ' 27' ' ' PHE . 11.3 t -62.68 -34.35 64.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.051 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.544 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 91.3 mmm -58.59 -42.34 87.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.648 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 34.9 mtp-105 -66.57 -33.28 75.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 109.776 177.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.493 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 16.4 mtm -59.74 -37.08 77.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.865 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.565 ' CD2' ' HB2' ' A' ' 156' ' ' ALA . 69.7 mt -87.06 0.05 55.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.63 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.75 7.69 52.93 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.179 -0.769 . . . . 0.0 111.179 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.648 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 23.1 mm100 -96.06 131.94 41.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 110.831 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.464 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 40.2 t-20 -127.87 60.6 46.64 Favored Pre-proline 0 C--N 1.324 -0.542 0 C-N-CA 120.109 -0.636 . . . . 0.0 110.943 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.509 ' HG3' ' HE3' ' A' ' 45' ' ' MET . 59.7 Cg_endo -76.72 138.35 18.93 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 C-N-CA 122.615 2.21 . . . . 0.0 112.355 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.1 p -72.06 154.06 92.5 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.0 110.502 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.98 -35.65 90.43 Favored 'Trans proline' 0 C--N 1.3 -1.996 0 C-N-CA 122.836 2.357 . . . . 0.0 111.705 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.88 -41.18 97.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.329 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' O ' ' HE2' ' A' ' 60' ' ' MET . 2.8 mt-10 -81.26 -37.25 28.81 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.086 0.469 . . . . 0.0 110.418 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.516 ' O ' HG13 ' A' ' 61' ' ' ILE . 52.4 mt -61.86 -31.24 71.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.525 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.522 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 46.5 tt0 -59.43 -42.33 91.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.989 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -67.0 -43.12 83.74 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.266 0.555 . . . . 0.0 110.557 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.503 ' HG2' ' S1 ' ' A' ' 201' ' ' V8Y . 3.4 mpp? -60.29 -38.52 83.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.34 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.622 HD13 ' N ' ' A' ' 38' ' ' THR . 1.1 mt -61.93 -46.83 95.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.024 0.44 . . . . 0.0 110.389 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.557 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 60.2 t0 -56.45 -26.7 54.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.396 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.544 ' O ' ' NH1' ' A' ' 83' ' ' ARG . 8.9 tp10 -45.77 -37.65 6.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.068 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.576 HG22 ' SD ' ' A' ' 80' ' ' MET . 0.2 OUTLIER -119.96 -13.77 8.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.741 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.515 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 29.2 t70 -86.39 68.12 10.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.521 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.514 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 86.7 tt0 -68.02 -17.17 64.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.67 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -12.66 60.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.62 -178.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.89 2.51 82.09 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.3 p -65.7 -18.24 65.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.838 0.351 . . . . 0.0 110.748 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.515 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 75.0 13.37 82.73 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.581 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.5 p -138.94 130.86 27.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.03 0.443 . . . . 0.0 110.802 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.572 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -96.45 112.8 29.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.917 179.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 14.0 p-10 -82.11 -165.83 1.1 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.371 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.601 ' CD1' ' HE2' ' A' ' 77' ' ' PHE . 2.1 t80 -57.08 -49.75 74.89 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.711 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -64.51 -44.22 91.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.778 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.493 ' OE1' ' HA ' ' A' ' 65' ' ' ASP . 54.8 mt-10 -64.9 -41.61 95.46 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.211 0.529 . . . . 0.0 110.477 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.638 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -67.53 -40.53 85.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.924 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.58 ' CD2' ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -58.37 -38.95 78.3 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.601 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 47.1 t -61.57 -40.01 85.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.895 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.769 ' CG ' ' H6 ' ' A' ' 201' ' ' V8Y . 32.4 mtm -58.36 -39.97 80.99 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.553 ' O ' ' HG3' ' A' ' 85' ' ' MET . 23.8 mmt -61.35 -43.86 98.15 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.011 0.434 . . . . 0.0 110.583 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.649 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER -76.27 -30.8 20.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.363 179.354 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.641 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 25.9 mtp180 -60.01 -44.6 94.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.12 0.486 . . . . 0.0 110.045 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 70.8 m -69.61 -39.82 77.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.531 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.557 ' CE ' ' HA ' ' A' ' 82' ' ' VAL . 74.1 mtm -61.9 -40.82 96.77 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.477 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.569 ' O ' ' O ' ' A' ' 87' ' ' ASP . 12.3 tptt -62.97 -42.64 99.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.156 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.569 ' O ' ' O ' ' A' ' 86' ' ' LYS . 62.1 t0 54.36 127.63 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.668 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.18 -41.24 96.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.701 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 75.7 m -63.08 -40.04 96.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.453 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 89' ' ' SER . 0.0 OUTLIER 71.38 -93.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.321 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -146.57 7.51 1.3 Allowed Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -72.09 149.41 44.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.783 0.325 . . . . 0.0 110.94 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -90.42 107.04 18.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.62 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.516 ' HE2' ' O ' ' A' ' 139' ' ' LYS . 0.0 OUTLIER -178.9 59.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.769 179.92 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.516 ' HB3' ' CD ' ' A' ' 141' ' ' PRO . 63.3 mtm180 -151.41 168.96 10.1 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.91 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.586 ' O ' ' OG1' ' A' ' 142' ' ' THR . 21.5 Cg_exo -64.69 -45.81 8.02 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 123.029 2.486 . . . . 0.0 112.319 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.586 ' OG1' ' O ' ' A' ' 141' ' ' PRO . 0.7 OUTLIER -175.57 -137.9 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.591 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.445 ' H ' HG23 ' A' ' 142' ' ' THR . 76.2 mt -102.32 10.37 39.2 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.657 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -64.71 141.23 58.85 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.577 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' A' ' 145' ' ' ARG . 0.0 OUTLIER -149.68 148.71 29.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.446 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 147' ' ' ARG . 23.2 t -129.8 -33.4 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.102 0.477 . . . . 0.0 110.226 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.643 ' O ' ' C ' ' A' ' 148' ' ' ILE . 0.0 OUTLIER -38.74 106.94 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.086 -179.865 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.643 ' C ' ' O ' ' A' ' 147' ' ' ARG . 21.1 tt -12.41 84.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.579 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.622 ' O ' ' CB ' ' A' ' 153' ' ' MET . 45.0 t -36.41 107.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.925 -179.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.2 87.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.879 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 65.3 m-20 -55.43 -71.31 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.41 0.624 . . . . 0.0 110.669 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.501 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -62.31 -34.52 76.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.758 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.635 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 6.2 ttt -50.87 -48.92 60.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.449 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.667 ' SD ' ' CD2' ' A' ' 20' ' ' PHE . 1.8 mtp -70.75 -27.89 64.28 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.285 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 86.4 mt-30 -59.37 -45.67 90.8 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.156 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.565 ' HB2' ' CD2' ' A' ' 48' ' ' LEU . . . -75.98 -29.32 58.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.253 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.607 ' CD1' ' CE1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -60.27 -40.18 89.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.689 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 65.9 mt -86.02 -8.5 57.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.988 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . 0.409 ' O ' ' CB ' ' A' ' 160' ' ' ALA . . . 71.44 30.68 66.5 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.409 ' CB ' ' O ' ' A' ' 159' ' ' GLY . . . 75.57 40.73 0.29 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.792 0.33 . . . . 0.0 110.487 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.537 ' HB2' ' HB3' ' A' ' 158' ' ' LEU . 0.1 OUTLIER -59.2 -73.81 0.08 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.753 -179.793 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -162.88 -178.31 6.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.665 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -118.79 -137.0 0.34 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.668 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -79.87 -161.31 22.94 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.768 -0.933 . . . . 0.0 110.768 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -72.59 -15.42 61.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.812 0.339 . . . . 0.0 110.385 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.91 -88.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.617 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . 0.468 ' HB3' ' O ' ' A' ' 170' ' ' HIS . 97.4 m-70 -116.88 19.15 14.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.582 ' CG ' ' H ' ' A' ' 169' ' ' HIS . 21.2 t-160 47.48 -123.99 1.56 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.531 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . 0.582 ' H ' ' CG ' ' A' ' 168' ' ' HIS . 54.4 p-80 -96.6 -9.28 29.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.805 0.335 . . . . 0.0 110.624 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . 0.5 ' ND1' ' CE1' ' A' ' 169' ' ' HIS . 46.9 p-80 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.802 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.878 ' H21' ' H12' ' A' ' 201' ' ' V8Y . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.491 ' CE ' HG22 ' A' ' 79' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -92.22 114.28 26.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.222 0.534 . . . . 0.0 110.717 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -63.32 -39.12 93.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.437 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.569 HG23 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -54.24 -47.06 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 121.429 0.633 . . . . 0.0 109.527 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.636 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 22.5 m-30 -71.05 -31.8 68.34 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.373 0.606 . . . . 0.0 109.584 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.491 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -57.17 -45.03 84.03 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.017 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.525 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -63.98 -35.89 82.18 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.177 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.54 ' HB2' ' O ' ' A' ' 5' ' ' TYR . . . -56.48 -40.38 74.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.641 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.582 ' CG2' ' HB3' ' A' ' 78' ' ' LEU . 79.7 t -62.07 -46.59 96.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.69 -24.35 63.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.628 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 23.5 mm100 -70.38 -36.94 74.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.635 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.594 HD13 ' CD1' ' A' ' 20' ' ' PHE . 23.4 mt -59.9 110.35 1.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.498 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.515 HG21 ' HB2' ' A' ' 16' ' ' GLN . 5.0 t -53.92 177.88 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.186 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 24.0 pt-20 -56.98 -37.48 71.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.694 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.425 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 79.3 tt0 -75.4 -46.93 29.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.197 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.515 ' HB2' HG21 ' A' ' 13' ' ' THR . 11.3 mt-30 -59.85 -48.51 81.39 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.794 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.461 ' CG ' ' HZ ' ' A' ' 74' ' ' PHE . 26.1 ttmt -65.6 -33.36 75.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.503 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 66.6 t30 -60.55 -43.44 97.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.292 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.52 ' O ' ' HE1' ' A' ' 154' ' ' MET . 1.1 tt0 -62.05 -51.78 66.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.408 0.623 . . . . 0.0 109.905 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.669 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 68.7 m-85 -65.31 -37.76 88.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.053 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -58.01 -40.8 81.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.737 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.599 ' O ' ' CD1' ' A' ' 26' ' ' ILE . . . -61.01 -41.83 97.29 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.533 ' HB3' ' CE ' ' A' ' 154' ' ' MET . . . -60.05 -38.6 83.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.052 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.626 ' CZ ' ' O ' ' A' ' 34' ' ' GLY . 41.6 t80 -57.37 -48.83 78.02 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.553 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 29' ' ' LEU . 67.0 t0 -61.55 -41.3 97.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.312 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.599 ' CD1' ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -59.54 -45.38 93.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.535 179.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.605 ' CE1' HG13 ' A' ' 44' ' ' VAL . 16.0 m-85 -61.13 -40.54 94.18 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.353 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.579 HG13 ' CG1' ' A' ' 36' ' ' ILE . 15.0 m -104.27 23.82 2.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.419 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.57 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -52.67 106.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 -179.61 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.34 7.01 67.9 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.529 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -65.52 135.59 55.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.743 0.306 . . . . 0.0 110.389 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.99 -41.39 95.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.175 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.3 p30 -96.91 -19.6 18.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.845 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.626 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 86.97 -8.62 75.57 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.59 ' CB ' ' OD1' ' A' ' 73' ' ' ASP . 54.6 p -80.91 136.42 36.05 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.579 ' CG1' HG13 ' A' ' 28' ' ' VAL . 96.5 mt -72.94 104.75 2.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.834 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.557 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 87.2 p -99.79 159.96 14.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.549 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.637 ' N ' HD12 ' A' ' 61' ' ' ILE . 1.3 p -41.57 -32.59 0.37 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.35 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -74.73 -43.42 55.09 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.172 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.621 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 4.8 mm-40 -74.49 -21.97 59.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.344 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 45' ' ' MET . 3.4 tt -83.32 -50.15 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.839 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.48 -37.13 94.18 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.621 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -46.4 -59.89 2.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 117.236 0.518 . . . . 0.0 109.986 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.605 HG13 ' CE1' ' A' ' 27' ' ' PHE . 9.6 t -62.03 -34.09 61.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.602 ' O ' ' N ' ' A' ' 50' ' ' GLN . 88.5 mmm -58.5 -43.31 89.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.009 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.609 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 21.7 mtt180 -67.24 -32.48 73.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.192 0.52 . . . . 0.0 109.73 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 26.0 mtm -60.79 -37.18 81.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.063 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.592 ' CD1' ' HA ' ' A' ' 153' ' ' MET . 57.3 mt -89.79 3.84 51.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.537 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.6 -3.62 57.74 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.609 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 8.2 mm100 -85.31 129.52 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.787 0.327 . . . . 0.0 111.137 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -129.19 61.44 57.14 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.906 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.539 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 58.7 Cg_endo -73.8 143.86 34.07 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 C-N-CA 122.542 2.161 . . . . 0.0 112.29 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.4 p -73.63 156.98 88.19 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 121.202 0.525 . . . . 0.0 110.551 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.85 -40.24 73.98 Favored 'Trans proline' 0 C--N 1.299 -2.059 0 C-N-CA 122.791 2.327 . . . . 0.0 112.017 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 52.5 mp0 -62.69 -40.4 97.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.391 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HE2' ' A' ' 60' ' ' MET . 1.6 tp10 -78.52 -37.77 42.27 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.44 0.638 . . . . 0.0 109.788 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.539 ' HG ' ' HB2' ' A' ' 52' ' ' PRO . 33.0 mt -61.05 -35.65 77.48 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.476 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.455 ' N ' HG21 ' A' ' 38' ' ' THR . 0.2 OUTLIER -59.0 -41.77 88.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.403 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -63.47 -41.67 98.59 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 110.028 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.47 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -65.14 -40.99 95.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.637 HD12 ' N ' ' A' ' 38' ' ' THR . 2.6 mt -61.61 -47.09 94.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.803 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.575 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 39.1 t70 -60.28 -29.37 68.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.719 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -54.23 -38.18 65.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.208 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.517 ' CG1' ' HD2' ' A' ' 83' ' ' ARG . 2.2 m -110.51 0.86 9.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.044 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.615 ' OD2' ' N ' ' A' ' 69' ' ' SER . 57.3 t0 -85.2 109.21 18.15 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.128 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.48 -49.09 72.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.982 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.555 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 51.8 p30 -89.34 -6.18 56.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.755 0.312 . . . . 0.0 110.673 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.46 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 65.66 27.04 72.25 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.615 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.1 p -68.52 4.22 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.858 0.361 . . . . 0.0 110.73 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.556 ' C ' HG23 ' A' ' 61' ' ' ILE . . . 74.77 16.08 80.48 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.587 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 4.6 p -141.31 128.91 21.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.601 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 0.2 OUTLIER -98.95 103.91 15.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.448 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.59 ' OD1' ' CB ' ' A' ' 35' ' ' SER . 66.4 m-20 -74.58 -164.96 0.31 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.39 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.587 ' HE1' ' CD2' ' A' ' 78' ' ' LEU . 4.4 t80 -57.21 -48.48 78.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.63 -48.39 75.05 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.784 0.326 . . . . 0.0 110.823 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.601 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 52.5 mt-10 -62.36 -41.68 98.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.289 0.566 . . . . 0.0 110.463 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.669 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -67.51 -41.15 84.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.057 0.456 . . . . 0.0 109.823 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.605 HD22 ' CE2' ' A' ' 77' ' ' PHE . 0.1 OUTLIER -56.07 -40.65 73.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.595 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.599 ' O ' HG12 ' A' ' 82' ' ' VAL . 43.9 t -61.08 -42.62 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.565 ' HE3' ' H7 ' ' A' ' 201' ' ' V8Y . 4.3 ttm -52.22 -44.77 64.99 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.666 ' O ' ' SD ' ' A' ' 85' ' ' MET . 33.6 mmt -60.28 -46.3 90.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.998 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.649 ' HA ' ' HB2' ' A' ' 85' ' ' MET . 0.2 OUTLIER -74.83 -26.87 19.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.653 179.511 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.636 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 83.4 mtt-85 -60.16 -44.79 94.72 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.984 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.579 ' O ' ' N ' ' A' ' 88' ' ' ASP . 79.4 p -92.74 -17.58 24.03 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.483 179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.666 ' SD ' ' O ' ' A' ' 81' ' ' MET . 0.0 OUTLIER -66.27 -46.06 78.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -60.93 -43.33 98.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.212 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.469 ' OD1' ' HA ' ' A' ' 84' ' ' SER . 54.4 p30 -104.94 18.1 22.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.38 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.579 ' N ' ' O ' ' A' ' 84' ' ' SER . 65.3 t0 -59.05 -46.15 88.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.46 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.636 ' O ' ' C ' ' A' ' 90' ' ' LYS . 69.6 m 43.13 26.45 0.09 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.596 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.636 ' C ' ' O ' ' A' ' 89' ' ' SER . 5.4 ptmt -0.53 -111.24 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.737 0.648 . . . . 0.0 110.864 -179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 137' ' ' LYS . . . 81.97 174.16 49.3 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 136' ' ' GLY . 0.0 OUTLIER 173.68 -67.63 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.794 0.331 . . . . 0.0 110.398 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -123.89 -15.3 6.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.665 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -102.74 -17.21 15.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.945 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.53 ' HB3' ' HD2' ' A' ' 141' ' ' PRO . 0.7 OUTLIER -116.6 175.25 2.03 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.826 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 140' ' ' ARG . 32.9 Cg_exo -60.54 149.66 85.66 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 123.377 2.718 . . . . 0.0 112.369 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.558 ' O ' ' HB2' ' A' ' 143' ' ' LEU . 6.4 t -70.91 -129.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.318 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' A' ' 142' ' ' THR . 42.1 mt 84.67 173.03 0.07 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.876 0.369 . . . . 0.0 110.578 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.489 ' CZ ' HG23 ' A' ' 146' ' ' VAL . 2.0 mmp_? -83.81 -111.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.259 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 51.06 41.39 27.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.518 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . 0.489 HG23 ' CZ ' ' A' ' 144' ' ' ARG . 21.2 t -87.26 -47.92 15.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.565 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.416 ' O ' ' O ' ' A' ' 146' ' ' VAL . 2.4 mpt_? 41.8 -164.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.406 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.599 ' CG2' ' O ' ' A' ' 148' ' ' ILE . 19.3 tt -70.4 76.72 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.195 0.521 . . . . 0.0 110.366 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.578 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -34.54 107.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.278 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.446 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.73 -39.19 83.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.569 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -43.28 -84.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.346 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' A' ' 155' ' ' GLN . . . -61.19 -33.91 74.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.226 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.596 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 6.3 ttt -48.22 -49.78 31.78 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.288 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.533 ' CE ' ' HB3' ' A' ' 23' ' ' ALA . 3.6 mtp -76.42 -27.04 56.13 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.534 179.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.569 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 76.0 mt-30 -60.37 -43.19 96.81 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.338 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.528 ' HB2' ' CD2' ' A' ' 48' ' ' LEU . . . -64.1 -44.68 91.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.024 0.44 . . . . 0.0 110.682 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -62.46 -43.17 99.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.582 -179.287 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.516 HD21 ' CB ' ' A' ' 22' ' ' ALA . 90.1 mt -82.57 -13.58 56.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.231 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . 0.488 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 59.04 31.12 68.0 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.623 ' O ' ' N ' ' A' ' 162' ' ' ALA . . . 76.5 -6.48 2.0 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.654 0.264 . . . . 0.0 110.681 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.59 ' O ' ' O ' ' A' ' 162' ' ' ALA . 6.7 ptm180 27.76 36.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.755 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.623 ' N ' ' O ' ' A' ' 160' ' ' ALA . . . 51.42 121.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.928 0.394 . . . . 0.0 110.497 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -59.42 127.01 29.96 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.509 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . 0.537 ' O ' ' CB ' ' A' ' 165' ' ' HIS . . . -82.41 165.41 44.62 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.537 ' CB ' ' O ' ' A' ' 164' ' ' GLY . 0.1 OUTLIER 158.82 -67.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.802 0.335 . . . . 0.0 110.702 179.659 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -153.32 160.55 42.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.734 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -159.8 162.27 34.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.818 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -150.24 -156.38 0.71 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.552 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -59.62 -9.34 2.55 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.416 -179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.566 -179.941 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.565 ' H7 ' ' HE3' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.558 ' O ' ' O ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.558 ' O ' ' O ' ' A' ' 1' ' ' MET . 4.5 m-20 40.7 101.74 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.98 0.419 . . . . 0.0 110.592 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.457 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 97.0 m-20 -60.36 -38.43 83.82 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.611 HD12 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -53.37 -46.67 58.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.271 -0.571 . . . . 0.0 109.651 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.6 m-30 -71.29 -29.69 65.36 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -58.73 -45.73 88.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.07 -34.56 78.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.288 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 5' ' ' TYR . . . -58.12 -40.83 82.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.847 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.549 HG23 HD13 ' A' ' 78' ' ' LEU . 94.0 t -62.87 -45.52 98.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -69.94 -26.98 64.39 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.412 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 12.1 mm100 -69.57 -37.9 77.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.588 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.545 HD23 ' OE1' ' A' ' 16' ' ' GLN . 20.2 mt -56.36 128.49 36.16 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.281 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.487 HG23 ' HG3' ' A' ' 16' ' ' GLN . 9.0 t -63.65 179.4 0.48 Allowed 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.092 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -61.4 -41.1 96.6 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.464 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -69.93 -42.12 73.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.84 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.545 ' OE1' HD23 ' A' ' 12' ' ' LEU . 71.4 mt-30 -61.89 -43.5 98.72 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.484 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 5.8 mtmt -71.96 -30.18 65.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.813 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -62.2 -49.05 77.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.227 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.583 ' O ' ' CE ' ' A' ' 154' ' ' MET . 64.4 mt-10 -63.14 -44.72 94.77 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.418 0.627 . . . . 0.0 110.37 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.65 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 39.0 m-85 -67.74 -37.07 81.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.674 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.456 ' N ' ' O ' ' A' ' 17' ' ' LYS . 29.1 tptp -60.78 -40.32 92.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.846 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.592 ' O ' ' CD1' ' A' ' 26' ' ' ILE . . . -60.01 -42.97 95.45 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.76 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.525 ' O ' ' HD1' ' A' ' 27' ' ' PHE . . . -61.07 -39.62 90.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.825 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.599 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 16.3 t80 -56.65 -48.8 76.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.645 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 29' ' ' LEU . 6.3 t70 -61.72 -41.67 97.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.827 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.592 ' CD1' ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.26 -44.46 83.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.667 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.601 ' CZ ' ' CG1' ' A' ' 44' ' ' VAL . 21.3 m-85 -61.92 -40.96 97.27 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.342 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.551 HG12 ' O ' ' A' ' 35' ' ' SER . 31.4 m -106.46 25.38 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.458 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.605 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -54.0 111.17 0.7 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.253 -179.519 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.84 3.06 83.67 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.503 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -62.66 136.6 57.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.353 . . . . 0.0 110.301 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 61.9 mp0 -64.81 -40.31 94.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.46 ' OD1' ' HB3' ' A' ' 35' ' ' SER . 11.0 t70 -96.98 -22.81 16.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.741 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.435 ' O ' HG13 ' A' ' 28' ' ' VAL . . . 89.07 -8.85 78.88 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.577 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 81.4 p -79.69 136.46 36.79 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.563 ' O ' ' HA ' ' A' ' 71' ' ' THR . 94.6 mt -73.77 104.15 2.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.551 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 83.5 p -97.01 168.09 10.67 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.073 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.663 ' N ' ' CD1' ' A' ' 61' ' ' ILE . 0.8 OUTLIER -49.16 -38.21 24.83 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.552 -179.471 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.45 -49.17 57.53 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.133 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.551 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 1.4 mp0 -64.51 -43.83 92.83 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.07 0.462 . . . . 0.0 110.743 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.59 HD23 ' SD ' ' A' ' 60' ' ' MET . 4.0 tt -64.98 -49.81 68.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.133 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.58 -31.83 79.17 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.118 -1.193 . . . . 0.0 110.118 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HE3' ' O ' ' A' ' 26' ' ' ILE . 0.0 OUTLIER -54.33 -54.05 45.56 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.648 ' CG2' ' SD ' ' A' ' 47' ' ' MET . 1.1 t -66.1 -32.22 57.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.59 ' SD ' HD11 ' A' ' 148' ' ' ILE . 89.5 mmm -59.18 -43.38 92.19 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 78.5 mtp85 -66.98 -37.85 84.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.703 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.648 ' SD ' ' CG2' ' A' ' 44' ' ' VAL . 1.3 ptm -55.08 -29.15 56.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.488 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.567 ' N ' ' HG2' ' A' ' 47' ' ' MET . 32.0 mt -94.79 0.02 54.56 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.808 -179.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.42 5.64 54.02 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.686 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 14.8 mm100 -88.86 135.68 33.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.926 0.393 . . . . 0.0 111.242 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.515 ' ND2' HH12 ' A' ' 46' ' ' ARG . 51.4 t-20 -128.67 60.45 49.25 Favored Pre-proline 0 C--N 1.32 -0.705 0 C-N-CA 119.474 -0.891 . . . . 0.0 111.089 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG3' ' HE3' ' A' ' 45' ' ' MET . 71.6 Cg_endo -77.05 144.69 24.04 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 C-N-CA 122.659 2.239 . . . . 0.0 112.471 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 p -80.68 153.53 73.2 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.101 0.477 . . . . 0.0 110.458 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.31 -36.69 94.19 Favored 'Trans proline' 0 C--N 1.3 -2.0 0 C-N-CA 122.792 2.328 . . . . 0.0 111.978 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.4 mp0 -62.45 -39.87 94.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.433 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -81.96 -34.42 29.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.908 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.566 ' CB ' HG23 ' A' ' 38' ' ' THR . 32.6 mt -64.93 -39.24 93.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.851 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.607 ' N ' HG23 ' A' ' 38' ' ' THR . 7.1 mt-30 -53.53 -50.18 66.02 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.839 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -62.92 -44.05 97.12 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.582 0.706 . . . . 0.0 109.953 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.59 ' SD ' HD23 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -58.52 -42.91 88.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.134 179.104 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.663 ' CD1' ' N ' ' A' ' 38' ' ' THR . 3.2 mt -60.61 -47.72 91.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.971 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.601 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 18.7 t70 -56.54 -22.31 32.27 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.578 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.448 ' HB3' ' O ' ' A' ' 60' ' ' MET . 51.6 tp10 -49.97 -39.54 41.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.528 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -115.1 -4.97 11.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.911 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.612 ' OD2' ' N ' ' A' ' 69' ' ' SER . 53.4 t0 -72.04 114.81 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.602 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -64.63 -46.5 82.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.58 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 59.5 p30 -94.06 -6.27 45.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.868 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.447 ' C ' ' H ' ' A' ' 70' ' ' GLY . . . 68.12 23.1 74.61 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.612 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.4 p -69.61 5.72 1.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.836 0.35 . . . . 0.0 110.699 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.611 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.68 17.52 80.0 Favored Glycine 0 CA--C 1.518 0.257 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.1 p -138.71 122.37 17.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.922 0.392 . . . . 0.0 111.106 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.619 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 0.2 OUTLIER -99.97 106.19 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.195 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.499 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.7 m-20 -73.62 -166.79 0.39 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.507 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.589 ' HE1' ' CD2' ' A' ' 78' ' ' LEU . 0.8 OUTLIER -57.85 -51.09 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.248 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -63.14 -43.51 98.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.859 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.619 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 68.6 mt-10 -64.62 -39.04 93.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.65 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -72.35 -39.18 68.3 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.198 0.523 . . . . 0.0 110.279 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.589 ' CD2' ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.7 -36.58 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -179.352 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.67 ' O ' HG12 ' A' ' 82' ' ' VAL . 48.8 t -59.95 -40.43 82.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.315 0.578 . . . . 0.0 109.732 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.417 ' HB2' HG11 ' A' ' 64' ' ' VAL . 9.5 ttt -57.2 -43.09 82.4 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.857 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.692 ' O ' ' SD ' ' A' ' 85' ' ' MET . 38.8 mmt -60.19 -47.5 85.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.113 0.482 . . . . 0.0 110.547 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.67 HG12 ' O ' ' A' ' 79' ' ' VAL . 0.2 OUTLIER -69.77 -31.05 47.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.377 179.231 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.618 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 90.6 mtt-85 -59.22 -39.84 83.95 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.216 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.7 p -85.0 -20.7 30.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.647 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.692 ' SD ' ' O ' ' A' ' 81' ' ' MET . 0.2 OUTLIER -66.3 -40.41 89.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.762 179.435 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -62.67 -42.57 99.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.489 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -61.23 -46.39 90.6 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.611 ' OD1' ' N ' ' A' ' 89' ' ' SER . 22.1 p30 -73.1 -20.74 60.88 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.862 0.363 . . . . 0.0 110.5 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.611 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 2.1 t 52.42 -81.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.795 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' A' ' 88' ' ' ASP . 1.9 ptmt -83.65 24.5 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.808 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -102.18 101.1 2.11 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.483 ' O ' ' CD1' ' A' ' 138' ' ' PHE . 18.9 mtpp -95.49 -51.14 4.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 0.0 110.435 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.483 ' CD1' ' O ' ' A' ' 137' ' ' LYS . 0.2 OUTLIER 164.78 20.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.763 179.862 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.424 ' HB3' ' H ' ' A' ' 140' ' ' ARG . 5.6 mmmt -59.89 -159.54 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.594 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.497 ' HB2' ' CD ' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -63.61 169.84 3.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.209 0.528 . . . . 0.0 110.095 -179.705 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.497 ' CD ' ' HB2' ' A' ' 140' ' ' ARG . 19.3 Cg_exo -64.4 107.77 0.89 Allowed 'Trans proline' 0 C--N 1.301 -1.954 0 C-N-CA 122.968 2.446 . . . . 0.0 111.422 -178.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.5 m -86.19 -132.52 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.441 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 86.3 mt -83.48 137.73 33.76 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.369 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 8.0 ptp180 -72.85 143.09 47.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.601 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -120.36 156.95 30.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.716 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 28.0 m -60.85 -24.56 32.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.546 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -75.18 149.79 38.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.688 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.59 HD11 ' SD ' ' A' ' 45' ' ' MET . 15.9 tt -45.4 103.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.346 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.504 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.7 OUTLIER -38.49 102.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.249 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.441 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.66 -39.64 89.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.725 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.535 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 3.5 t0 -45.89 -79.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.134 0.492 . . . . 0.0 110.659 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.406 ' H ' ' HB3' ' A' ' 151' ' ' ASP . . . -61.16 -35.53 77.36 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.762 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.589 ' O ' ' HG ' ' A' ' 157' ' ' LEU . 11.0 ttt -48.0 -51.6 23.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.323 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.583 ' CE ' ' O ' ' A' ' 19' ' ' GLU . 1.6 mtp -70.44 -30.16 66.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.363 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.535 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 21.9 mt-30 -60.8 -42.54 97.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.022 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.448 ' HB1' HD21 ' A' ' 48' ' ' LEU . . . -64.02 -43.79 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.486 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.2 OUTLIER -66.49 -42.79 86.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.675 -179.32 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 154' ' ' MET . 75.1 mt -79.43 -8.05 58.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.194 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . 0.482 ' O ' ' HB1' ' A' ' 160' ' ' ALA . . . 61.54 31.23 76.93 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 159' ' ' GLY . . . 67.12 26.73 8.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.905 0.383 . . . . 0.0 110.507 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 158' ' ' LEU . 14.8 mtm180 -62.08 117.75 6.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.934 0.397 . . . . 0.0 110.525 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . 54.05 17.69 1.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.609 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 4.0 mptt -139.03 111.54 7.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.375 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . 0.441 ' O ' ' CB ' ' A' ' 165' ' ' HIS . . . 106.67 156.41 21.03 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.441 ' CB ' ' O ' ' A' ' 164' ' ' GLY . 0.0 OUTLIER 165.82 -29.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.499 -179.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.575 ' O ' ' O ' ' A' ' 167' ' ' HIS . 56.2 p-80 -67.39 -175.44 0.49 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.447 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . 0.575 ' O ' ' O ' ' A' ' 166' ' ' HIS . 1.9 t-160 -27.51 148.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.317 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -51.3 142.34 13.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.269 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . 0.552 ' O ' ' HB2' ' A' ' 170' ' ' HIS . 32.8 p80 -78.39 2.32 19.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.75 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . 0.552 ' HB2' ' O ' ' A' ' 169' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.546 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.539 ' H17' ' H ' ' A' ' 148' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.539 ' HG3' ' CB ' ' A' ' 66' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.411 ' O ' ' O ' ' A' ' 1' ' ' MET . 80.3 m-20 44.09 93.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.474 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.85 -40.77 76.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.33 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.556 HG22 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -52.45 -47.18 47.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.422 0.63 . . . . 0.0 110.098 179.273 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.662 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 22.9 m-30 -70.3 -32.04 69.64 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HZ3' ' HB3' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -57.66 -44.02 85.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.491 0.662 . . . . 0.0 109.223 178.963 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.78 76.73 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.255 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 5' ' ' TYR . . . -57.86 -40.33 79.92 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.588 HG22 ' CD1' ' A' ' 78' ' ' LEU . 83.8 t -62.84 -45.36 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.42 -23.81 62.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.395 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.38 -34.63 70.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.842 -179.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.599 HD12 ' CE1' ' A' ' 20' ' ' PHE . 15.7 mt -61.55 123.99 19.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.575 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.534 ' OG1' ' N ' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -60.88 -179.14 0.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.659 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.534 ' N ' ' OG1' ' A' ' 13' ' ' THR . 49.3 tp10 -60.34 -48.37 82.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.892 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -65.69 -43.25 89.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.012 0.434 . . . . 0.0 110.847 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.523 ' H ' HG23 ' A' ' 13' ' ' THR . 4.6 mt-30 -58.17 -50.83 72.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.748 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HD3' ' HZ ' ' A' ' 74' ' ' PHE . 21.3 ttmt -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.955 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -61.11 -46.32 91.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.082 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.464 ' O ' ' CE ' ' A' ' 154' ' ' MET . 0.4 OUTLIER -64.64 -46.08 84.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.487 0.661 . . . . 0.0 110.168 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.667 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 43.8 m-85 -62.34 -37.11 84.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.735 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.402 ' NZ ' ' HB2' ' A' ' 74' ' ' PHE . 57.8 tptt -58.56 -38.89 78.81 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.547 ' O ' ' CD1' ' A' ' 26' ' ' ILE . . . -60.32 -41.56 93.78 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.529 ' CB ' ' HE3' ' A' ' 154' ' ' MET . . . -61.67 -38.71 88.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.851 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.645 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 14.1 t80 -58.29 -49.27 77.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.768 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' A' ' 29' ' ' LEU . 57.4 t0 -61.97 -40.79 96.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.547 ' CD1' ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -57.91 -44.78 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.812 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.665 ' CE1' HG13 ' A' ' 44' ' ' VAL . 16.7 m-85 -63.46 -38.12 89.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.049 0.452 . . . . 0.0 110.504 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.559 HG12 ' C ' ' A' ' 35' ' ' SER . 6.9 m -104.71 21.09 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.684 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.546 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -55.76 101.76 0.06 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.384 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.88 5.06 54.05 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.417 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -69.14 139.17 54.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.682 0.277 . . . . 0.0 110.62 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -66.79 -42.33 86.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.305 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.531 ' OD2' ' OG ' ' A' ' 35' ' ' SER . 56.4 p-10 -99.98 -15.49 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.537 ' O ' HG13 ' A' ' 28' ' ' VAL . . . 89.28 -8.63 79.41 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.615 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 52.7 p -75.73 135.47 40.35 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.602 ' HB ' HG12 ' A' ' 72' ' ' VAL . 85.4 mt -74.71 106.22 4.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.549 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 38.7 t -101.26 157.87 16.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.068 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.631 ' N ' ' CD1' ' A' ' 61' ' ' ILE . 0.8 OUTLIER -39.16 -43.53 1.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.53 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.11 -41.75 90.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 110.361 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.624 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 6.9 mp0 -75.8 -21.7 57.08 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.454 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.578 ' O ' ' HG2' ' A' ' 45' ' ' MET . 2.6 tt -83.84 -47.94 10.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.842 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.542 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.09 -38.99 96.49 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.624 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.74 -57.87 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.152 0.501 . . . . 0.0 110.283 179.347 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.665 HG13 ' CE1' ' A' ' 27' ' ' PHE . 37.1 t -62.56 -35.02 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.056 177.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.578 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 90.5 mmm -56.53 -43.18 79.58 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.726 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 50.9 mtp180 -64.44 -35.49 81.1 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.074 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.51 ' HE1' ' HA ' ' A' ' 44' ' ' VAL . 19.1 mtm -60.32 -28.59 68.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.116 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.59 ' CD2' ' HB1' ' A' ' 156' ' ' ALA . 24.7 mt -95.81 5.56 51.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.222 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 95.73 -2.14 64.24 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.592 -1.003 . . . . 0.0 110.592 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.726 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -84.76 135.93 33.92 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 110.869 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.448 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 24.1 p30 -129.97 58.83 40.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.223 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.534 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 65.8 Cg_endo -80.33 146.54 17.6 Favored 'Trans proline' 0 C--N 1.304 -1.808 0 C-N-CA 122.787 2.325 . . . . 0.0 111.926 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 p -80.02 153.08 74.79 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.62 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.23 -40.8 79.8 Favored 'Trans proline' 0 C--N 1.301 -1.93 0 C-N-CA 122.839 2.359 . . . . 0.0 112.081 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.5 mp0 -62.49 -39.32 93.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.29 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.494 ' O ' ' HE1' ' A' ' 60' ' ' MET . 0.2 OUTLIER -80.54 -34.14 35.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.42 179.65 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 52' ' ' PRO . 16.3 mt -62.04 -29.48 70.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.713 179.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.544 ' N ' HG22 ' A' ' 38' ' ' THR . 1.0 OUTLIER -56.44 -36.4 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.46 -179.585 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -62.27 -48.75 78.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 0.0 110.901 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.658 ' N ' ' SD ' ' A' ' 60' ' ' MET . 2.0 mpp? -63.53 -39.48 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.524 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.631 ' CD1' ' N ' ' A' ' 38' ' ' THR . 1.5 mt -61.96 -44.74 99.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.193 0.52 . . . . 0.0 110.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.524 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.9 t70 -59.01 -35.48 73.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.587 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.48 ' OE1' ' H4 ' ' A' ' 201' ' ' V8Y . 88.0 tt0 -51.5 -42.46 61.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.684 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.473 ' CG1' ' HD2' ' A' ' 83' ' ' ARG . 3.1 m -106.63 3.54 10.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.681 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.55 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 34.5 t70 -107.74 90.34 3.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.366 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.539 ' CB ' ' HG3' ' A' ' 1' ' ' MET . 40.5 tt0 -79.57 -19.18 50.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.37 -11.95 60.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.643 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.48 19.09 68.48 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.0 p -86.32 -7.9 58.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.832 0.348 . . . . 0.0 110.875 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.541 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 74.06 17.45 79.48 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.626 -0.989 . . . . 0.0 110.626 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.615 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.1 p -137.48 128.59 27.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.044 0.449 . . . . 0.0 110.613 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.602 HG12 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -97.58 105.43 17.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.503 179.649 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.0 m-20 -74.11 -161.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.69 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.6 ' HD1' ' CE2' ' A' ' 77' ' ' PHE . 1.7 t80 -58.79 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.874 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.414 ' HB3' ' HZ3' ' A' ' 6' ' ' LYS . 96.8 m-20 -63.62 -42.48 98.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.632 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.55 ' OE1' ' HA ' ' A' ' 65' ' ' ASP . 48.0 mt-10 -66.37 -41.38 89.53 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.311 0.577 . . . . 0.0 110.577 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.667 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -67.85 -37.83 82.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.936 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.618 HD21 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -59.1 -40.68 86.06 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.692 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.619 ' O ' HG13 ' A' ' 82' ' ' VAL . 53.8 t -62.15 -39.21 83.09 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.094 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.587 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.503 ' HE3' ' H6 ' ' A' ' 201' ' ' V8Y . 1.4 ttm -57.02 -42.99 81.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.249 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.564 ' CE ' ' HE3' ' A' ' 153' ' ' MET . 22.1 mmt -60.51 -45.38 94.0 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.035 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.626 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER -75.85 -27.63 18.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.494 178.768 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.662 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 3.4 mtt85 -64.87 -39.25 93.25 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.911 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.441 ' OG ' HG23 ' A' ' 146' ' ' VAL . 37.0 t -86.47 -48.24 8.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.988 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.569 ' CE ' ' HA ' ' A' ' 82' ' ' VAL . 3.6 ptp -62.64 -17.99 61.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.562 -179.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.525 ' HB2' ' O ' ' A' ' 82' ' ' VAL . 57.7 tptt -54.81 -34.62 62.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.472 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.56 ' OD1' ' N ' ' A' ' 88' ' ' ASP . 58.9 p30 -60.17 -19.99 56.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.415 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.56 ' N ' ' OD1' ' A' ' 87' ' ' ASP . 97.9 m-20 -63.28 -40.0 96.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.645 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 61.6 p -119.04 14.53 13.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.888 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.541 ' HB3' ' HA ' ' A' ' 87' ' ' ASP . 10.0 pttp -71.25 179.2 2.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.503 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.422 ' N ' ' HG3' ' A' ' 90' ' ' LYS . . . 75.55 -167.61 54.79 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 138' ' ' PHE . 14.6 mptt 59.49 93.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.689 0.281 . . . . 0.0 110.571 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.485 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 16.9 m-85 66.84 13.58 9.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.767 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -136.78 144.85 43.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.678 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.52 ' HB2' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -74.62 171.55 11.16 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.351 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.52 ' HD2' ' HB2' ' A' ' 140' ' ' ARG . 48.2 Cg_endo -83.3 78.69 3.11 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 123.29 2.66 . . . . 0.0 112.312 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.2 m -59.96 -45.95 90.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.447 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' ' 143' ' ' LEU . 39.8 mt -142.6 71.7 1.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.6 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.43 ' O ' ' CG ' ' A' ' 144' ' ' ARG . 7.7 ptm180 -59.18 128.57 37.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? 61.2 156.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.372 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . 0.441 HG23 ' OG ' ' A' ' 84' ' ' SER . 10.4 p -141.97 152.21 18.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.693 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -95.2 -46.01 6.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.644 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.518 ' CG2' ' O ' ' A' ' 148' ' ' ILE . 0.1 OUTLIER -78.19 118.41 25.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.483 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.62 ' O ' ' CB ' ' A' ' 153' ' ' MET . 12.5 m -87.95 102.2 14.5 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -52.48 -34.99 51.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.413 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.582 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 16.2 t0 -56.79 -80.07 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.231 0.539 . . . . 0.0 110.456 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.551 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -61.57 -34.36 75.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.646 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 4.9 ttt -45.64 -61.45 1.7 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.073 0.463 . . . . 0.0 110.252 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.529 ' HE3' ' CB ' ' A' ' 23' ' ' ALA . 6.5 mtp -63.91 -28.19 69.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.185 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 72.8 mt-30 -60.75 -40.64 93.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.194 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.59 ' HB1' ' CD2' ' A' ' 48' ' ' LEU . . . -65.0 -39.92 94.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.392 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.531 ' HB3' ' CG1' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -73.89 -46.47 44.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.583 -179.494 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 154' ' ' MET . 83.9 mt -70.3 -41.27 73.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.828 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 102.55 -48.61 1.04 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . 175.11 43.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.551 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.615 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 3.8 mmm180 -76.91 153.21 34.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.509 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.615 ' CB ' ' O ' ' A' ' 161' ' ' ARG . . . 91.65 101.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.903 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 26.4 mtmt -64.3 -37.94 89.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.625 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . 0.58 ' O ' ' HB2' ' A' ' 165' ' ' HIS . . . 70.99 -117.57 6.96 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.801 -0.92 . . . . 0.0 110.801 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.58 ' HB2' ' O ' ' A' ' 164' ' ' GLY . 60.7 m170 73.33 76.88 0.14 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.995 0.426 . . . . 0.0 110.853 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -93.04 138.1 31.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.522 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 12.2 m170 -64.64 148.64 50.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.83 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -72.97 160.26 32.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.375 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 -59.06 -45.09 91.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.358 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.385 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.544 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.503 ' H6 ' ' HE3' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -70.07 113.08 6.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.442 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.11 -39.89 91.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.291 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.571 HG21 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -54.1 -47.79 66.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.351 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.629 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.9 m-30 -71.66 -31.86 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -46.09 82.91 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.531 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.4 -35.61 81.45 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.565 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.32 -40.37 77.78 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.568 HG22 ' CD1' ' A' ' 78' ' ' LEU . 92.3 t -61.07 -47.14 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -69.12 -30.65 68.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.095 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.531 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 92.4 mm-40 -69.4 -36.56 76.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.924 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.596 HD11 ' CD1' ' A' ' 20' ' ' PHE . 13.5 mt -51.4 125.37 14.18 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.797 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.558 ' CG2' ' H ' ' A' ' 16' ' ' GLN . 9.9 t -60.66 167.9 2.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.259 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.525 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.8 tm-20 -60.08 -42.27 94.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.777 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -70.8 -50.7 32.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.163 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.558 ' H ' ' CG2' ' A' ' 13' ' ' THR . 5.9 tt0 -61.89 -44.76 96.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.143 0.497 . . . . 0.0 110.333 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.547 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -66.56 -33.43 75.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.773 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 65.0 t30 -58.25 -42.58 86.71 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.99 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.4 ' O ' ' HE1' ' A' ' 154' ' ' MET . 24.1 mt-10 -62.67 -45.48 92.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.032 0.444 . . . . 0.0 110.051 179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.64 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 12.8 m-85 -64.81 -38.98 92.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.343 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.7 tptp -59.68 -40.93 89.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.727 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.503 ' O ' ' CD1' ' A' ' 26' ' ' ILE . . . -60.79 -41.77 96.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.489 ' O ' ' HD1' ' A' ' 27' ' ' PHE . . . -61.83 -38.76 89.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.004 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.639 ' HB2' ' CE2' ' A' ' 77' ' ' PHE . 23.2 t80 -57.4 -49.13 77.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.649 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.542 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.42 -39.16 92.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.384 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.522 ' HA ' ' CD1' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -57.06 -47.44 83.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.627 -179.772 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.617 ' CE1' HG13 ' A' ' 44' ' ' VAL . 25.4 m-85 -61.88 -42.27 98.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.494 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.539 ' CG1' ' HA ' ' A' ' 36' ' ' ILE . 18.9 m -101.2 22.91 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.657 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.542 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -57.75 100.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.408 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.97 -5.58 53.45 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.453 ' HB1' ' HB ' ' A' ' 28' ' ' VAL . . . -60.17 138.24 57.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.835 0.35 . . . . 0.0 110.514 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.87 -41.21 91.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.996 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.66 -22.97 19.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.778 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 28' ' ' VAL . . . 89.0 -9.38 77.02 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.535 ' C ' HG12 ' A' ' 28' ' ' VAL . 89.3 p -82.72 136.2 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.6 ' HB ' ' O ' ' A' ' 72' ' ' VAL . 96.4 mt -69.05 104.8 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.597 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.615 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 8.9 p -98.63 156.33 16.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.669 ' N ' ' CD1' ' A' ' 61' ' ' ILE . 0.1 OUTLIER -39.48 -38.48 0.58 Allowed 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.481 -179.277 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.76 -46.06 76.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.976 0.417 . . . . 0.0 110.171 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.615 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 6.7 mp0 -68.75 -39.42 80.3 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.644 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.621 ' O ' ' HG2' ' A' ' 45' ' ' MET . 6.4 tt -60.5 -49.05 79.09 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.444 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.577 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.09 -36.27 92.69 Favored Glycine 0 CA--C 1.531 1.033 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.459 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -51.23 -62.93 1.32 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.039 0.447 . . . . 0.0 109.99 179.596 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.617 HG13 ' CE1' ' A' ' 27' ' ' PHE . 4.7 t -58.8 -30.88 43.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.903 178.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.621 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 81.4 mmm -59.18 -41.99 89.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.281 -0.418 . . . . 0.0 109.874 179.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.678 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 77.1 mtp180 -67.61 -31.26 71.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.031 0.443 . . . . 0.0 109.847 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.462 ' HE1' ' HA ' ' A' ' 44' ' ' VAL . 19.8 mtm -61.59 -35.96 79.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.098 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.562 ' CD2' ' HB2' ' A' ' 156' ' ' ALA . 11.0 mt -90.3 2.64 55.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.568 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.69 -1.0 56.72 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.678 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 28.1 mm100 -86.0 134.72 33.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.855 0.359 . . . . 0.0 110.855 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.598 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 31.8 p30 -131.41 60.1 50.17 Favored Pre-proline 0 C--N 1.326 -0.429 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.4 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HD3' ' N ' ' A' ' 51' ' ' ASN . 3.6 Cg_exo -75.9 157.83 38.85 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 C-N-CA 123.519 2.812 . . . . 0.0 112.124 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.4 p -89.28 154.2 48.95 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.03 0.443 . . . . 0.0 110.389 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.61 -42.02 71.92 Favored 'Trans proline' 0 C--N 1.302 -1.916 0 C-N-CA 122.716 2.277 . . . . 0.0 112.031 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.16 -44.76 95.89 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.887 0.375 . . . . 0.0 110.262 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.592 ' O ' ' SD ' ' A' ' 60' ' ' MET . 54.2 tp10 -71.64 -38.53 70.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.167 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.638 ' O ' ' HG2' ' A' ' 60' ' ' MET . 41.9 mt -60.62 -24.11 65.25 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.759 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.45 ' N ' HG23 ' A' ' 38' ' ' THR . 34.9 tt0 -64.3 -39.9 94.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.827 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -61.1 -44.14 97.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.108 0.48 . . . . 0.0 110.758 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.646 ' HE2' ' H8M' ' A' ' 201' ' ' V8Y . 0.0 OUTLIER -67.53 -39.67 85.05 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.346 179.585 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.669 ' CD1' ' N ' ' A' ' 38' ' ' THR . 1.4 mt -61.52 -46.06 97.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 38.2 t70 -59.19 -37.45 77.46 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.589 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.477 ' CD ' ' H4 ' ' A' ' 201' ' ' V8Y . 61.4 tt0 -47.44 -35.03 7.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.543 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.57 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 2.5 m -118.51 6.11 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.682 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.455 ' OD2' ' N ' ' A' ' 70' ' ' GLY . 59.0 t0 -117.08 83.24 1.94 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.06 -17.42 63.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 -13.0 60.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.522 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.22 13.68 60.47 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.3 p -76.58 -12.54 60.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.698 0.285 . . . . 0.0 110.995 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.537 ' C ' HG22 ' A' ' 61' ' ' ILE . . . 75.02 16.29 80.65 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.565 ' HA ' ' O ' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -134.48 115.24 13.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.978 0.418 . . . . 0.0 111.101 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.6 ' O ' ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -90.58 105.55 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.199 179.311 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.531 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -72.69 -162.97 0.11 Allowed 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.65 179.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.564 ' HD1' ' CE2' ' A' ' 77' ' ' PHE . 0.7 OUTLIER -58.1 -51.41 69.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.811 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -65.33 -42.27 93.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.711 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.57 ' O ' ' HB ' ' A' ' 64' ' ' VAL . 53.0 mt-10 -62.36 -42.24 99.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.451 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.64 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -73.89 -42.86 60.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.127 0.489 . . . . 0.0 110.142 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.59 HD22 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -52.11 -34.77 45.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.732 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.636 ' O ' HG13 ' A' ' 82' ' ' VAL . 46.4 t -60.58 -44.06 95.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.002 178.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 5.2 ptp -56.97 -40.1 75.87 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.053 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.593 ' O ' ' HG3' ' A' ' 85' ' ' MET . 35.2 mmt -61.55 -45.43 94.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.146 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.636 HG13 ' O ' ' A' ' 79' ' ' VAL . 0.2 OUTLIER -76.13 -25.0 16.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.213 179.158 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.61 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 62.3 mtt-85 -60.54 -41.41 94.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.718 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.469 ' O ' ' HA3' ' A' ' 136' ' ' GLY . 96.4 p -86.27 -30.61 22.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.034 0.445 . . . . 0.0 110.544 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.593 ' HG3' ' O ' ' A' ' 81' ' ' MET . 65.0 mtm -59.35 -33.81 71.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.73 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.5 ' C ' ' H ' ' A' ' 88' ' ' ASP . 12.8 tttm -41.79 -44.69 3.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.452 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.503 ' OD2' ' O ' ' A' ' 85' ' ' MET . 46.5 m-20 59.77 1.37 0.3 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.586 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.5 ' H ' ' C ' ' A' ' 86' ' ' LYS . 67.5 m-20 -87.69 -38.38 15.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.845 0.355 . . . . 0.0 110.493 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 70.6 m -120.36 -25.32 5.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.564 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -156.08 160.45 39.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.678 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.469 ' HA3' ' O ' ' A' ' 84' ' ' SER . . . 94.39 -16.36 61.24 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.044 -0.823 . . . . 0.0 111.044 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -66.85 -40.53 87.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.836 0.35 . . . . 0.0 110.767 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -54.93 135.37 48.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.574 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.546 ' O ' ' HB2' ' A' ' 140' ' ' ARG . 7.6 ptmt -159.86 142.34 13.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.851 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.59 ' CD ' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER 167.22 155.96 0.12 Allowed Pre-proline 0 N--CA 1.463 0.195 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.708 179.474 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.59 ' HD2' ' CD ' ' A' ' 140' ' ' ARG . 57.2 Cg_endo -86.0 -8.71 7.78 Favored 'Trans proline' 0 C--N 1.298 -2.101 0 C-N-CA 123.45 2.767 . . . . 0.0 112.206 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.485 ' H ' ' HD2' ' A' ' 140' ' ' ARG . 1.5 m -45.61 -75.13 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.446 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.403 ' HG ' ' C ' ' A' ' 142' ' ' THR . 97.3 mt -150.12 151.74 33.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.505 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.448 ' HD2' ' OG ' ' A' ' 149' ' ' SER . 0.0 OUTLIER -133.3 77.33 1.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.829 179.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -115.51 18.96 15.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.765 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . 0.6 ' O ' ' C ' ' A' ' 147' ' ' ARG . 2.1 m -118.33 -165.24 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.739 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.6 ' C ' ' O ' ' A' ' 146' ' ' VAL . 7.3 ptp85 -19.97 128.52 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.347 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.52 ' CD1' ' HG3' ' A' ' 153' ' ' MET . 20.7 tt -38.85 139.9 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.644 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.646 ' O ' ' CB ' ' A' ' 153' ' ' MET . 43.0 m -76.17 84.07 3.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -44.28 -37.64 3.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.61 -88.24 0.0 OUTLIER 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.261 0.553 . . . . 0.0 110.907 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.13 -25.95 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.759 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.646 ' CB ' ' O ' ' A' ' 149' ' ' SER . 0.0 OUTLIER -52.36 -49.87 63.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.454 179.754 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.489 ' SD ' ' HD2' ' A' ' 20' ' ' PHE . 1.9 mtp -69.74 -31.47 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.479 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -60.23 -41.87 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.313 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.562 ' HB2' ' CD2' ' A' ' 48' ' ' LEU . . . -65.76 -43.66 88.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.033 0.444 . . . . 0.0 110.966 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -63.24 -44.63 94.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.577 -179.433 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 83.2 mt -82.65 -6.83 59.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.221 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . 0.5 ' O ' ' HB1' ' A' ' 160' ' ' ALA . . . 68.31 28.64 73.19 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.921 -0.871 . . . . 0.0 110.921 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.5 ' HB1' ' O ' ' A' ' 159' ' ' GLY . . . 74.19 39.94 0.46 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.779 0.323 . . . . 0.0 110.396 -179.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 15.5 ttt85 -81.37 134.59 35.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.699 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -124.27 131.54 53.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.391 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . 0.421 ' O ' ' HE1' ' A' ' 168' ' ' HIS . 22.1 tttt -139.85 128.75 23.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.522 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 101.92 79.15 1.37 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.986 -0.845 . . . . 0.0 110.986 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.482 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 97.9 m-70 56.23 41.0 29.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.74 0.305 . . . . 0.0 110.755 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.482 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 0.1 OUTLIER 76.7 -154.03 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.622 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -69.01 171.3 8.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.694 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.421 ' HE1' ' O ' ' A' ' 163' ' ' LYS . 69.3 m80 -120.11 49.14 1.45 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.214 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . 0.568 ' O ' ' C ' ' A' ' 170' ' ' HIS . 86.3 t60 -59.31 -45.66 90.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.387 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . 0.568 ' C ' ' O ' ' A' ' 169' ' ' HIS . 0.2 OUTLIER . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.579 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.646 ' H8M' ' HE2' ' A' ' 60' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.474 ' HG3' ' HB2' ' A' ' 66' ' ' GLU . 3.6 mtp . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.65 106.57 0.36 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.478 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.521 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 98.3 m-20 -61.23 -38.52 86.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.966 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.628 HG21 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -55.63 -45.83 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 121.37 0.605 . . . . 0.0 109.476 179.655 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.635 ' CD2' HG22 ' A' ' 82' ' ' VAL . 21.0 m-30 -71.88 -30.25 65.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.534 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.2 mmpt? -57.56 -46.11 84.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.553 0.692 . . . . 0.0 109.194 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 11' ' ' GLN . . . -63.87 -35.28 80.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.157 177.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.516 ' HB2' ' O ' ' A' ' 5' ' ' TYR . . . -57.37 -40.95 79.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.663 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.562 HG21 HD11 ' A' ' 78' ' ' LEU . 75.7 t -62.9 -46.28 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -73.6 -20.42 60.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.038 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.474 ' N ' ' O ' ' A' ' 7' ' ' ALA . 2.8 mt-30 -71.06 -36.25 72.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.86 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.617 HD11 ' CD1' ' A' ' 20' ' ' PHE . 31.3 mt -56.41 128.01 33.86 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.557 HG22 ' CB ' ' A' ' 16' ' ' GLN . 7.5 t -60.67 167.7 2.58 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.959 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -55.42 -39.75 70.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.835 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -74.18 -46.84 39.57 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.745 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.557 ' CB ' HG22 ' A' ' 13' ' ' THR . 65.5 tt0 -62.68 -43.97 97.45 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.964 0.411 . . . . 0.0 110.588 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.542 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 30.8 ttmt -65.61 -35.55 81.14 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -60.51 -43.71 96.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.853 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -62.66 -46.5 87.91 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.683 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 23.5 m-85 -65.07 -39.45 93.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.876 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -59.36 -39.94 84.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.747 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.52 ' O ' HD11 ' A' ' 26' ' ' ILE . . . -60.03 -41.27 91.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.71 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.539 ' HB1' ' CE ' ' A' ' 154' ' ' MET . . . -60.69 -39.73 89.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.999 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.645 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 29.8 t80 -57.8 -48.91 78.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.846 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 29' ' ' LEU . 47.8 t0 -63.01 -39.23 94.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.548 ' CG1' ' HB3' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -57.37 -44.28 83.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.748 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.61 ' CZ ' ' CE ' ' A' ' 153' ' ' MET . 14.4 m-85 -61.85 -42.13 98.67 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.056 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.542 HG11 ' C ' ' A' ' 35' ' ' SER . 6.6 m -101.29 25.14 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.746 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -56.28 107.59 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.262 -179.642 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.63 6.15 80.73 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.468 ' HB2' ' HB ' ' A' ' 28' ' ' VAL . . . -64.52 139.42 58.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.547 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -64.24 -41.88 96.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.991 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.51 -22.35 17.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.643 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.491 ' O ' HG12 ' A' ' 28' ' ' VAL . . . 88.02 -8.52 77.9 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.627 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 92.1 p -83.44 136.99 34.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.342 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.565 ' HB ' ' O ' ' A' ' 72' ' ' VAL . 97.5 mt -73.45 106.71 3.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.172 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.599 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 32.5 p -102.17 -175.1 2.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.152 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.607 HG23 ' CD1' ' A' ' 61' ' ' ILE . 6.4 p -64.19 -30.32 71.39 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.442 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.6 mmtt -72.58 -50.53 24.84 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.192 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.599 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 20.4 mp0 -69.68 -40.71 76.22 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.296 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.609 HD11 ' SD ' ' A' ' 60' ' ' MET . 8.2 tt -62.32 -51.4 67.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.434 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.475 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.85 -30.34 77.72 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.452 ' NZ ' ' O ' ' A' ' 26' ' ' ILE . 0.0 OUTLIER -54.56 -49.86 69.32 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.768 0.318 . . . . 0.0 110.262 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.64 ' CG2' ' SD ' ' A' ' 47' ' ' MET . 1.3 t -72.94 -30.41 32.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.615 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.1 mmm -59.31 -45.08 92.27 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.587 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 73.4 mtp85 -67.25 -37.49 83.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.64 ' SD ' ' CG2' ' A' ' 44' ' ' VAL . 1.5 ptm -52.9 -30.23 33.02 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.499 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.541 ' CD1' ' HA ' ' A' ' 153' ' ' MET . 16.6 mt -93.31 -5.46 49.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.776 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 105.57 7.42 36.89 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.587 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 58.9 mm-40 -85.44 138.86 31.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.777 0.322 . . . . 0.0 111.038 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.448 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 30.1 t-20 -126.36 59.14 29.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.376 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.538 ' HB2' ' OE2' ' A' ' 56' ' ' GLU . 73.4 Cg_endo -80.19 142.04 14.94 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 C-N-CA 122.718 2.279 . . . . 0.0 112.864 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.548 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 63.6 p -81.16 160.5 65.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.376 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -56.86 -36.82 99.07 Favored 'Trans proline' 0 C--N 1.295 -2.271 0 C-N-CA 122.747 2.298 . . . . 0.0 111.761 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -62.18 -49.47 75.66 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.978 0.418 . . . . 0.0 110.763 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 53' ' ' THR . 1.3 pp20? -72.56 -34.99 67.88 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.646 ' O ' HG13 ' A' ' 61' ' ' ILE . 38.2 mt -65.16 -41.7 94.43 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.584 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.588 ' N ' HG21 ' A' ' 38' ' ' THR . 29.0 tt0 -61.93 -42.22 98.84 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.18 -179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -62.55 -51.8 65.95 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.426 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.609 ' SD ' HD11 ' A' ' 41' ' ' LEU . 2.5 ppp? -58.49 -34.65 71.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.035 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.646 HG13 ' O ' ' A' ' 57' ' ' LEU . 15.5 mt -60.92 -44.57 98.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.082 0.468 . . . . 0.0 110.807 177.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.578 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 34.1 t70 -61.0 -27.43 68.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.854 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -49.4 -38.44 28.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.62 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -111.95 -3.78 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.732 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.608 ' OD2' ' N ' ' A' ' 69' ' ' SER . 51.4 t0 -79.65 104.78 10.48 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.195 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.474 ' HB2' ' HG3' ' A' ' 1' ' ' MET . 64.4 tt0 -63.62 -45.59 89.61 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.418 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.573 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 54.6 p30 -91.38 -0.19 57.61 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.839 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.539 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 60.42 29.75 69.92 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.608 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 3.0 p -69.79 -0.02 6.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.839 0.352 . . . . 0.0 110.763 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.572 ' C ' HG22 ' A' ' 61' ' ' ILE . . . 76.77 14.23 82.76 Favored Glycine 0 CA--C 1.521 0.409 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.0 p -139.74 132.51 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.565 ' O ' ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -101.64 110.0 27.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.002 179.173 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.451 ' CG ' ' OE1' ' A' ' 76' ' ' GLU . 55.2 p-10 -78.98 -169.05 1.65 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.227 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.554 ' HE1' ' CD2' ' A' ' 78' ' ' LEU . 1.1 t80 -55.64 -50.09 71.13 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.452 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.449 ' HB3' ' HZ1' ' A' ' 6' ' ' LYS . 98.2 m-20 -62.43 -42.77 99.7 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.118 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.543 ' OE2' ' HA ' ' A' ' 65' ' ' ASP . 25.7 mt-10 -64.81 -42.07 95.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.381 0.61 . . . . 0.0 110.354 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.683 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -69.62 -44.9 69.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.916 179.532 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.628 HD21 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -57.05 -37.21 71.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.599 ' HA ' ' CG1' ' A' ' 82' ' ' VAL . 42.1 t -60.97 -43.25 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.207 178.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.528 ' HE1' ' H6 ' ' A' ' 201' ' ' V8Y . 1.6 ttm -54.48 -42.76 71.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.536 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.537 ' O ' ' HG3' ' A' ' 85' ' ' MET . 14.4 mmt -59.85 -45.45 92.39 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.49 . . . . 0.0 110.282 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.635 HG22 ' CD2' ' A' ' 5' ' ' TYR . 0.6 OUTLIER -72.23 -31.87 40.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.434 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.616 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 59.8 mtt-85 -60.95 -43.67 98.37 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.321 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.585 ' O ' ' N ' ' A' ' 88' ' ' ASP . 95.0 p -70.63 -35.4 72.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.261 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.562 ' CE ' ' HA ' ' A' ' 82' ' ' VAL . 52.6 mtm -61.89 -40.92 97.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.727 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.7 tptp -68.86 -42.11 77.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 110.649 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -99.68 13.4 33.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.631 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.585 ' N ' ' O ' ' A' ' 84' ' ' SER . 16.3 t0 -56.48 -49.52 74.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.029 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.5 t -141.19 132.39 26.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.783 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.466 ' N ' ' HG1' ' A' ' 142' ' ' THR . 2.1 tmtp? -61.37 -45.11 95.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.501 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -124.11 -103.02 1.53 Allowed Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -120.16 -62.15 1.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.845 0.355 . . . . 0.0 110.666 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.586 ' O ' ' N ' ' A' ' 140' ' ' ARG . 15.3 m-85 -149.76 -93.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.659 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.496 ' C ' ' O ' ' A' ' 138' ' ' PHE . 1.5 mtpt 31.3 -89.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.817 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.586 ' N ' ' O ' ' A' ' 138' ' ' PHE . 19.5 mmt180 -118.89 165.25 17.4 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.205 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.541 ' HD2' ' HB3' ' A' ' 140' ' ' ARG . 56.3 Cg_endo -83.01 164.83 15.31 Favored 'Trans proline' 0 C--N 1.298 -2.08 0 C-N-CA 123.62 2.88 . . . . 0.0 112.375 -178.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.564 HG22 ' N ' ' A' ' 143' ' ' LEU . 88.7 m -63.75 -97.89 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.966 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.564 ' N ' HG22 ' A' ' 142' ' ' THR . 0.5 OUTLIER -126.12 -81.52 0.62 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.713 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 31.5 mtp-105 -109.71 129.38 55.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.254 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.56 ' C ' ' CG2' ' A' ' 146' ' ' VAL . 54.6 mtm180 -114.62 -157.67 0.64 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.347 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . 0.56 ' CG2' ' C ' ' A' ' 145' ' ' ARG . 1.3 t 77.64 44.7 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.439 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.607 ' O ' ' C ' ' A' ' 148' ' ' ILE . 0.2 OUTLIER -96.47 86.78 4.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.542 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.615 HD12 ' SD ' ' A' ' 45' ' ' MET . 11.1 tt 16.38 73.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.8 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.564 ' C ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -26.88 111.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.635 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.67 -39.49 88.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.483 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.549 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -44.69 -80.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.132 0.492 . . . . 0.0 110.457 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.81 -35.81 77.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.773 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.61 ' CE ' ' CZ ' ' A' ' 27' ' ' PHE . 13.6 ttt -49.94 -51.84 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.885 0.374 . . . . 0.0 110.291 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.539 ' CE ' ' HB1' ' A' ' 23' ' ' ALA . 16.1 mtp -69.43 -32.04 70.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.472 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.549 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.6 mt-30 -59.9 -42.06 93.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.103 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.461 ' HB1' ' CD2' ' A' ' 48' ' ' LEU . . . -63.52 -42.88 98.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.388 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.4 OUTLIER -66.65 -38.04 86.05 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.55 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 154' ' ' MET . 86.9 mt -82.91 -7.52 59.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.383 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 66.46 29.97 75.73 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . 66.35 35.46 5.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.77 0.319 . . . . 0.0 110.613 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.33 98.89 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.297 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -136.34 177.11 8.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.655 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 167' ' ' HIS . 2.1 mptm? -115.8 107.48 15.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.627 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -91.16 -170.34 42.63 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.42 103.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.798 0.332 . . . . 0.0 110.329 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 63.4 m170 61.32 34.04 18.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.649 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . 0.478 ' HB3' ' O ' ' A' ' 163' ' ' LYS . 26.6 p80 -76.76 168.96 19.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.725 179.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 32.5 p80 -155.69 161.43 40.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.488 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -160.42 167.78 26.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.654 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 10.4 p80 . . . . . 0 C--O 1.221 -0.402 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.665 179.959 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.528 ' H6 ' ' HE1' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.532 ' HB2' ' OE1' ' A' ' 66' ' ' GLU . 27.3 ttt . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.576 ' OD2' ' CE1' ' A' ' 5' ' ' TYR . 0.5 OUTLIER -43.36 99.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.475 -179.859 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.401 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 79.2 m-20 -61.57 -40.72 95.77 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.593 HD13 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -56.0 -46.71 80.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.362 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.65 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.1 m-30 -68.65 -33.68 74.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.54 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -56.89 -46.86 81.63 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -62.55 -35.71 80.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -55.66 -40.95 72.96 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.251 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.528 HG21 HD12 ' A' ' 78' ' ' LEU . 68.8 t -63.14 -46.95 94.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.91 -23.3 61.45 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.543 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 84.2 mm-40 -70.43 -35.72 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.658 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.602 HD13 ' CD1' ' A' ' 20' ' ' PHE . 21.9 mt -57.76 126.09 25.85 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.641 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.561 HG23 ' CB ' ' A' ' 16' ' ' GLN . 1.5 t -64.12 175.19 1.31 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.284 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.0 mm-40 -60.88 -43.06 98.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.59 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -71.55 -48.14 50.5 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.561 ' CB ' HG23 ' A' ' 13' ' ' THR . 8.1 tt0 -61.18 -43.86 98.21 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.295 0.569 . . . . 0.0 110.393 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -68.26 -32.23 72.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.63 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.2 t-20 -60.87 -44.24 97.33 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.884 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -60.71 -44.37 96.68 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.129 0.49 . . . . 0.0 109.835 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.653 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 30.6 m-85 -66.76 -38.04 85.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.847 179.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -60.25 -40.11 89.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.074 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.79 -42.02 92.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.741 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.594 ' O ' ' HD1' ' A' ' 27' ' ' PHE . . . -62.21 -40.29 95.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.574 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 16.8 t80 -57.64 -49.17 77.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.787 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 29' ' ' LEU . 36.1 t70 -63.49 -40.16 96.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.606 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.567 ' O ' ' NZ ' ' A' ' 43' ' ' LYS . 0.6 OUTLIER -57.81 -44.02 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.584 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.631 ' CE1' ' HE2' ' A' ' 153' ' ' MET . 17.4 m-85 -61.71 -43.12 99.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.738 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.528 HG12 ' O ' ' A' ' 35' ' ' SER . 28.0 m -102.9 26.96 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.562 ' HB3' ' NZ ' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -57.49 105.67 0.26 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.376 -179.722 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 3.4 67.82 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.464 ' HB2' ' HA2' ' A' ' 34' ' ' GLY . . . -63.44 136.44 57.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.289 . . . . 0.0 110.368 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -61.81 -44.79 96.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.544 ' O ' ' OD1' ' A' ' 33' ' ' ASP . 64.6 t0 -92.43 -22.37 19.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 31' ' ' ALA . . . 88.51 -8.04 80.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.548 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 59.5 p -81.15 137.52 35.93 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.631 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 72' ' ' VAL . 96.6 mt -74.19 105.8 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.056 0.455 . . . . 0.0 110.974 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.594 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 4.8 p -102.45 -172.49 2.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.693 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.581 HG21 ' C ' ' A' ' 57' ' ' LEU . 16.3 p -60.88 -37.18 81.27 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.437 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -69.93 -49.18 54.53 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.337 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.594 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 46.9 mp0 -64.35 -42.9 96.0 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.638 ' O ' ' HG2' ' A' ' 45' ' ' MET . 0.5 OUTLIER -64.06 -48.54 75.83 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.89 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.48 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.2 -37.55 94.71 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.581 -1.008 . . . . 0.0 110.581 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.567 ' NZ ' ' O ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -50.37 -63.45 1.12 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 109.851 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.653 ' O ' ' CD2' ' A' ' 48' ' ' LEU . 13.2 t -59.45 -36.29 63.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.638 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 77.8 mmm -55.35 -39.5 70.12 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.646 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 10.4 mtm105 -66.68 -32.85 74.42 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.539 ' HE3' ' HA ' ' A' ' 44' ' ' VAL . 32.6 mtm -59.18 -37.43 77.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.653 ' CD2' ' O ' ' A' ' 44' ' ' VAL . 2.3 mm? -83.76 -5.33 59.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.623 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.37 11.22 34.14 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.646 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -91.25 138.74 31.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.154 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.44 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 34.6 p30 -127.24 57.75 25.75 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.892 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.515 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 68.9 Cg_endo -78.47 150.4 25.02 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.711 2.274 . . . . 0.0 112.56 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.7 p -89.96 156.51 46.78 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.597 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.463 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 52.3 Cg_exo -55.6 -40.26 86.35 Favored 'Trans proline' 0 C--N 1.301 -1.935 0 C-N-CA 122.762 2.308 . . . . 0.0 111.909 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -61.3 -49.65 76.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.497 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.458 ' O ' ' SD ' ' A' ' 60' ' ' MET . 78.7 mm-40 -69.37 -38.99 78.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.18 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.581 ' C ' HG21 ' A' ' 38' ' ' THR . 26.3 mt -60.25 -28.43 68.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.698 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.432 ' N ' HG21 ' A' ' 38' ' ' THR . 39.5 tt0 -58.87 -40.02 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.126 -179.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -63.49 -47.85 80.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.631 0.729 . . . . 0.0 110.779 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.533 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.17 -38.9 90.85 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.914 179.698 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.538 HG21 ' O ' ' A' ' 70' ' ' GLY . 17.3 mm -62.36 -45.56 98.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.362 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.594 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.0 t70 -64.26 -23.14 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.807 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.531 ' O ' ' NH1' ' A' ' 83' ' ' ARG . 42.6 tp10 -53.66 -41.08 66.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.572 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.516 HG11 ' CB ' ' A' ' 80' ' ' MET . 0.9 OUTLIER -114.68 -3.52 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.4 . . . . 0.0 110.718 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.594 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 63.5 t0 -88.16 88.67 7.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.532 ' OE1' ' HB2' ' A' ' 1' ' ' MET . 77.9 tt0 -71.88 -26.74 62.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.924 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.56 -11.46 60.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.967 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.04 21.73 64.06 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.019 -0.833 . . . . 0.0 111.019 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 p -85.93 0.7 52.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.887 0.375 . . . . 0.0 110.747 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.538 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 72.69 15.51 77.84 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.548 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 9.8 p -139.43 126.9 21.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.903 0.382 . . . . 0.0 110.657 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.6 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 0.2 OUTLIER -91.37 107.72 19.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.348 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.463 ' OD1' ' CG ' ' A' ' 76' ' ' GLU . 52.3 p-10 -74.34 -169.08 0.75 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.508 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.592 ' HD1' ' CE2' ' A' ' 77' ' ' PHE . 1.8 t80 -57.41 -50.69 72.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 -179.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -62.93 -41.92 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.816 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.6 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 30.8 mt-10 -64.87 -43.26 93.52 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.189 0.519 . . . . 0.0 110.381 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.653 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -68.88 -39.76 79.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.443 0.639 . . . . 0.0 109.724 179.739 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.587 HD23 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -60.38 -37.03 79.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.431 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.685 ' O ' HG13 ' A' ' 82' ' ' VAL . 28.3 t -61.88 -42.28 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.967 178.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.568 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 2.6 ptp -56.48 -38.54 71.87 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.878 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.577 ' O ' ' HG3' ' A' ' 85' ' ' MET . 21.1 mmt -62.42 -47.76 82.67 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.685 HG13 ' O ' ' A' ' 79' ' ' VAL . 0.1 OUTLIER -72.39 -33.01 44.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.292 179.179 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.607 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 72.5 mtt180 -60.57 -43.82 96.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.248 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 72.4 m -69.94 -38.24 76.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.331 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.585 ' CE ' ' HA ' ' A' ' 82' ' ' VAL . 67.2 mtm -61.38 -40.78 95.59 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.655 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.554 ' O ' ' OD2' ' A' ' 87' ' ' ASP . 5.0 mmtt -78.82 -29.37 44.71 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.48 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.554 ' OD2' ' O ' ' A' ' 86' ' ' LYS . 0.0 OUTLIER 60.31 -170.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.492 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.438 ' O ' ' C ' ' A' ' 89' ' ' SER . 54.9 p-10 -82.41 -3.42 55.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.613 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 88' ' ' ASP . 82.7 p -37.12 130.64 0.84 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.471 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -154.77 92.85 1.5 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.51 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.44 -133.02 11.41 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.51 -89.36 0.28 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 0.0 110.664 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -112.0 123.29 49.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.712 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 2.7 mtpt -106.21 -177.5 3.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.6 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.579 ' HB2' ' CD ' ' A' ' 141' ' ' PRO . 8.9 ptp180 -110.95 179.88 0.74 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.301 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.579 ' CD ' ' HB2' ' A' ' 140' ' ' ARG . 29.2 Cg_exo -60.51 102.55 0.19 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.856 2.371 . . . . 0.0 111.864 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 141' ' ' PRO . 85.4 m -169.96 126.45 0.84 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.76 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 142' ' ' THR . 68.3 mt 67.02 66.59 0.42 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.832 0.348 . . . . 0.0 110.829 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.498 ' O ' ' NH1' ' A' ' 147' ' ' ARG . 77.7 mtt-85 -66.25 148.54 51.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.78 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.491 ' O ' ' HD2' ' A' ' 147' ' ' ARG . 11.7 mtm-85 -68.31 -94.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.68 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . 0.469 ' CG2' ' C ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER 43.59 32.48 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.469 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.498 ' NH1' ' O ' ' A' ' 144' ' ' ARG . 0.8 OUTLIER -87.4 169.75 11.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.463 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.46 ' C ' ' O ' ' A' ' 147' ' ' ARG . 5.4 tp -34.98 124.95 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.465 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.61 ' O ' ' CB ' ' A' ' 153' ' ' MET . 29.6 m -71.87 88.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.986 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.552 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.62 -31.95 69.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.834 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -53.02 -48.69 67.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.038 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.408 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -107.56 -18.98 13.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.954 0.407 . . . . 0.0 111.064 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.631 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -57.12 -45.98 83.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.226 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.561 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 mtp -70.01 -29.82 66.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.577 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.408 ' OE1' ' HA ' ' A' ' 152' ' ' ALA . 82.3 mt-30 -62.05 -39.61 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.449 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.474 ' HB1' HD12 ' A' ' 48' ' ' LEU . . . -62.27 -25.27 67.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.781 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.601 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.1 OUTLIER -97.13 -51.97 4.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.756 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 94.6 mt -69.51 -38.14 77.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.543 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . 0.416 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 90.3 42.73 5.15 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 69.04 40.07 1.65 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.786 0.327 . . . . 0.0 110.632 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.471 ' HB2' ' HB3' ' A' ' 158' ' ' LEU . 69.0 mtp85 -105.34 -11.1 16.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.543 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -133.19 45.0 2.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.48 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -46.74 128.51 10.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.322 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -96.67 106.18 3.32 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.899 -0.881 . . . . 0.0 110.899 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 37.7 m170 -64.52 -40.16 95.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.59 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.0 t-160 -71.82 125.69 27.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.572 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -147.69 71.75 1.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.282 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.466 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 53.5 t-80 60.19 38.88 19.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.661 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -116.53 127.76 54.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.698 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.498 179.923 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.442 ' H8N' HE21 ' A' ' 50' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.538 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 96.1 mtp . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -60.95 126.6 27.96 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.48 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 71.4 m-20 -68.82 -39.5 80.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.573 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.627 HD12 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -54.7 -47.89 72.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.649 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.65 ' CD2' HG22 ' A' ' 82' ' ' VAL . 20.9 m-30 -69.2 -31.89 70.8 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.53 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.76 -45.37 89.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.05 -34.15 76.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.569 ' HB1' ' O ' ' A' ' 5' ' ' TYR . . . -58.39 -42.01 86.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.758 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.583 ' O ' ' HE2' ' A' ' 17' ' ' LYS . 95.4 t -63.71 -43.95 98.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -68.58 -24.3 64.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.522 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -71.15 -35.4 71.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.691 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.628 HD13 ' CD1' ' A' ' 20' ' ' PHE . 17.2 mt -64.5 107.8 1.48 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.277 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.609 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -51.21 -179.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.649 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.538 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 76.5 mm-40 -60.92 -44.77 96.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.981 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -70.92 -45.7 63.8 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.95 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.609 ' H ' HG23 ' A' ' 13' ' ' THR . 29.5 tt0 -63.66 -44.34 94.08 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.178 0.514 . . . . 0.0 110.127 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.583 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.6 ttmt -70.44 -30.83 67.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.589 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.538 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 63.0 t30 -60.33 -44.46 95.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.106 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.41 -45.44 93.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.106 0.479 . . . . 0.0 109.947 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.657 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 28.4 m-85 -65.11 -39.01 92.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.198 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -60.53 -39.51 88.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.836 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.485 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.53 -42.22 96.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.852 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB3' HD13 ' A' ' 157' ' ' LEU . . . -61.66 -39.41 91.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.181 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.642 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 17.2 t80 -57.27 -48.63 78.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.638 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.587 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.75 -39.55 94.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.527 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.589 HG22 ' CG2' ' A' ' 44' ' ' VAL . 0.6 OUTLIER -56.65 -45.88 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.528 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CE1' HG11 ' A' ' 44' ' ' VAL . 22.6 m-85 -62.03 -41.99 98.69 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.365 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.518 HG13 ' O ' ' A' ' 35' ' ' SER . 15.7 m -101.57 21.36 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.427 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -53.12 112.47 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.325 -179.825 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.32 -9.07 78.35 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.15 127.03 29.38 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.247 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.11 -41.39 97.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.56 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.5 p30 -81.36 -22.38 38.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.874 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.56 ' N ' ' OD1' ' A' ' 33' ' ' ASP . . . 78.73 -2.5 68.01 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.57 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 57.6 p -90.6 136.93 32.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.62 ' HB ' HG11 ' A' ' 72' ' ' VAL . 96.7 mt -73.6 106.22 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.662 -0.415 . . . . 0.0 111.358 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.585 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 56.1 p -101.94 161.65 13.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.798 179.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.734 ' N ' HD13 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -41.66 -35.58 0.79 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.611 -179.339 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -49.54 57.31 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.588 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 3.4 mp0 -67.18 -40.06 86.51 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 45' ' ' MET . 6.6 tt -60.06 -50.44 73.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.44 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.48 ' CA ' HD12 ' A' ' 57' ' ' LEU . . . -64.93 -35.74 92.26 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.5 -60.98 2.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.22 0.534 . . . . 0.0 109.947 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.658 ' O ' ' CD2' ' A' ' 48' ' ' LEU . 25.5 t -61.06 -38.93 80.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 177.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.599 ' HB3' ' HB2' ' A' ' 50' ' ' GLN . 88.8 mmm -54.46 -41.6 69.67 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.626 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 71.6 mtp180 -65.01 -32.65 74.49 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.563 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 33.1 mtm -58.7 -37.3 75.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.658 ' CD2' ' O ' ' A' ' 44' ' ' VAL . 2.1 mm? -85.76 0.01 54.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.516 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.36 5.45 57.01 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.626 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 5.8 mm-40 -80.53 138.49 36.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.961 0.41 . . . . 0.0 110.955 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.454 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 26.6 p-10 -128.54 56.79 24.28 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.309 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG3' ' HE1' ' A' ' 45' ' ' MET . 64.0 Cg_endo -77.67 139.86 18.27 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.721 2.281 . . . . 0.0 112.864 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.6 p -78.6 158.16 76.29 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.47 -35.21 84.57 Favored 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.726 2.284 . . . . 0.0 111.824 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -61.02 -51.6 68.53 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.21 0.529 . . . . 0.0 110.387 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.579 ' O ' ' CE ' ' A' ' 60' ' ' MET . 72.9 mt-10 -69.64 -39.89 76.84 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.327 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.486 HD23 ' CD2' ' A' ' 41' ' ' LEU . 43.4 mt -61.48 -37.75 84.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.678 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.52 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 50.6 tt0 -59.8 -41.36 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.733 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -62.85 -41.86 99.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.255 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.619 ' HE1' ' H12' ' A' ' 201' ' ' V8Y . 4.4 mmt -62.57 -39.09 92.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.734 HD13 ' N ' ' A' ' 38' ' ' THR . 2.8 mt -61.65 -45.7 98.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.459 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 14.9 t70 -60.14 -36.08 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.565 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -45.98 -38.91 8.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.157 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.544 ' CG1' ' HD3' ' A' ' 83' ' ' ARG . 0.6 OUTLIER -113.88 -10.11 12.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.466 ' OD2' ' OD1' ' A' ' 67' ' ' ASP . 16.0 t70 -96.65 67.37 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.323 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.538 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 51.0 mt-10 -67.71 -17.62 64.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.793 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.466 ' OD1' ' OD2' ' A' ' 65' ' ' ASP . 49.6 p-10 -75.93 -10.3 59.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.496 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.68 14.45 75.26 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.451 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 88.1 p -71.86 -16.84 62.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.617 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.97 17.04 78.34 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.578 ' CG2' ' HB3' ' A' ' 37' ' ' SER . 0.2 OUTLIER -149.2 119.43 7.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.924 0.392 . . . . 0.0 110.76 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.62 HG11 ' HB ' ' A' ' 36' ' ' ILE . 0.1 OUTLIER -85.99 110.38 19.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.44 179.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.536 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -81.49 -162.29 0.5 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.56 ' HD1' ' CE2' ' A' ' 77' ' ' PHE . 1.9 t80 -56.72 -49.52 74.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.775 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -44.96 85.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.644 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.536 ' HB2' ' N ' ' A' ' 73' ' ' ASP . 53.2 mt-10 -62.69 -41.37 99.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.321 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.657 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -71.04 -44.34 66.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.186 0.517 . . . . 0.0 109.634 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.651 HD23 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -56.1 -37.33 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.619 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.651 ' O ' HG12 ' A' ' 82' ' ' VAL . 42.6 t -63.84 -41.73 93.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.037 178.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.716 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -54.25 -38.34 65.68 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.204 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.716 ' N ' ' HG2' ' A' ' 80' ' ' MET . 12.7 mmt -65.36 -48.25 73.61 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 121.255 0.55 . . . . 0.0 110.848 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 79' ' ' VAL . 0.1 OUTLIER -72.78 -28.75 27.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.613 179.543 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.636 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 65.0 mtp85 -59.18 -48.06 83.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.634 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 84.8 p -70.48 -37.0 74.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.668 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.572 ' CE ' ' HA ' ' A' ' 82' ' ' VAL . 67.9 mtm -60.83 -48.03 83.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.385 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.57 ' O ' ' O ' ' A' ' 89' ' ' SER . 57.2 mmtt -66.81 -40.45 88.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.893 0.378 . . . . 0.0 110.9 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -69.95 -39.6 75.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.796 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -61.59 -44.71 96.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.988 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.57 ' O ' ' O ' ' A' ' 86' ' ' LYS . 41.9 t -135.98 165.81 24.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.746 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.534 ' O ' ' HD3' ' A' ' 90' ' ' LYS . 11.1 tmtt? 66.91 132.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.134 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -153.35 -109.46 0.38 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.614 ' O ' ' CB ' ' A' ' 138' ' ' PHE . 17.8 mtmt -105.08 15.46 27.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.468 0.175 . . . . 0.0 110.774 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.614 ' CB ' ' O ' ' A' ' 137' ' ' LYS . 31.4 t80 91.56 -15.9 0.18 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.539 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.538 ' CG ' ' N ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -92.8 -77.35 0.44 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.446 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.538 ' N ' ' CG ' ' A' ' 139' ' ' LYS . 49.5 mtt180 -136.69 165.55 34.34 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.684 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.497 ' HD2' ' HB3' ' A' ' 140' ' ' ARG . 51.3 Cg_endo -84.85 -11.2 7.92 Favored 'Trans proline' 0 C--N 1.302 -1.908 0 C-N-CA 123.146 2.564 . . . . 0.0 112.439 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.9 m 71.93 -75.9 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.512 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 90.4 mt -119.24 143.19 47.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.613 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.18 34.8 4.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.508 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.599 ' C ' ' HD2' ' A' ' 147' ' ' ARG . 99.9 mtt180 -59.93 108.3 0.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.459 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . 0.494 ' C ' ' HD3' ' A' ' 147' ' ' ARG . 10.1 m -83.71 -25.76 7.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.391 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.599 ' HD2' ' C ' ' A' ' 145' ' ' ARG . 0.0 OUTLIER 53.17 -150.57 0.36 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.681 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.495 HG22 ' O ' ' A' ' 148' ' ' ILE . 12.6 tt -38.06 124.79 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.485 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.576 ' O ' ' CB ' ' A' ' 153' ' ' MET . 3.4 m -70.19 103.73 2.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.387 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.474 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.85 -38.81 83.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.341 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -45.02 -82.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.458 ' H ' ' HB2' ' A' ' 151' ' ' ASP . . . -60.41 -35.2 75.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.805 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.603 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 9.5 ttt -49.74 -52.41 31.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.245 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.48 ' HE1' ' HB3' ' A' ' 23' ' ' ALA . 10.7 mtp -71.1 -29.21 64.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.481 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.603 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 52.7 mt-30 -60.3 -44.09 95.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.345 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.507 ' HB3' HD12 ' A' ' 48' ' ' LEU . . . -63.54 -42.81 98.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.077 0.465 . . . . 0.0 110.17 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.2 OUTLIER -64.37 -42.13 96.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.642 -179.533 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.439 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 85.4 mt -88.21 -2.88 58.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.405 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . 0.474 ' O ' ' HB1' ' A' ' 160' ' ' ALA . . . 49.41 35.96 22.4 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 159' ' ' GLY . . . 69.13 45.93 0.85 Allowed 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.593 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.439 ' HB2' ' HB3' ' A' ' 158' ' ' LEU . 4.3 mtp180 -45.6 -35.74 4.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.642 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -154.31 167.4 30.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.647 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -144.9 -164.81 2.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.401 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 85.83 11.55 73.56 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.577 ' O ' ' O ' ' A' ' 166' ' ' HIS . 0.1 OUTLIER -102.44 -88.29 0.39 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.813 0.34 . . . . 0.0 110.765 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.577 ' O ' ' O ' ' A' ' 165' ' ' HIS . 98.3 m-70 37.5 -166.4 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.626 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . 0.455 ' CE1' ' NE2' ' A' ' 168' ' ' HIS . 1.8 p80 -94.5 3.21 55.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.79 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.556 ' O ' ' C ' ' A' ' 169' ' ' HIS . 98.9 m-70 -102.15 -15.64 16.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.655 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . 0.556 ' C ' ' O ' ' A' ' 168' ' ' HIS . 83.7 t60 25.43 -109.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.552 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . 0.516 ' C ' ' O ' ' A' ' 169' ' ' HIS . 12.2 m-70 . . . . . 0 C--O 1.219 -0.534 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.608 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.619 ' H12' ' HE1' ' A' ' 60' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.524 ' HG2' ' HB2' ' A' ' 66' ' ' GLU . 8.9 mmm . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.515 ' OD2' ' CE1' ' A' ' 5' ' ' TYR . 1.2 m-20 71.71 105.21 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.746 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 45.9 m-20 -62.06 -44.26 97.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.019 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.571 HG21 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -50.81 -46.75 29.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 121.025 0.44 . . . . 0.0 109.982 179.091 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.669 ' CD1' ' HG2' ' A' ' 83' ' ' ARG . 22.2 m-30 -69.95 -34.0 72.85 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.602 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -54.9 -45.61 74.74 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.302 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 11' ' ' GLN . . . -65.1 -33.27 75.63 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.578 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.84 -40.27 83.75 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.581 HG23 HD13 ' A' ' 78' ' ' LEU . 95.1 t -61.98 -46.13 97.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.046 0.45 . . . . 0.0 109.788 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -73.42 -23.78 60.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 7' ' ' ALA . 3.1 mm-40 -72.03 -38.6 69.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.779 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.607 HD11 ' CD1' ' A' ' 20' ' ' PHE . 21.5 mt -49.4 118.72 2.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.734 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.556 HG21 ' HB2' ' A' ' 16' ' ' GLN . 8.8 t -56.33 -177.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.374 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.53 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 88.0 tt0 -60.04 -44.01 94.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -74.0 -51.23 16.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.556 ' HB2' HG21 ' A' ' 13' ' ' THR . 13.0 mt-30 -50.47 -52.76 35.23 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.591 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.0 ttmt -66.18 -35.06 79.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.046 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 62.2 t30 -59.6 -43.77 93.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.199 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.5 ' O ' ' HE3' ' A' ' 154' ' ' MET . 12.6 mt-10 -61.02 -46.92 88.78 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.196 0.522 . . . . 0.0 110.492 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.64 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 67.4 m-85 -66.15 -38.54 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.224 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -56.5 -42.58 78.57 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.564 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.77 -40.86 94.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.915 178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.529 ' HA ' HD12 ' A' ' 26' ' ' ILE . . . -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.185 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.612 ' HB2' ' CE2' ' A' ' 77' ' ' PHE . 15.9 t80 -57.32 -48.23 79.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.444 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.609 ' O ' ' N ' ' A' ' 29' ' ' LEU . 64.6 t0 -62.23 -40.02 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.393 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.564 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.33 -46.35 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.75 179.674 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.646 ' CZ ' ' HE2' ' A' ' 153' ' ' MET . 12.9 m-85 -60.66 -41.32 94.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.459 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.557 HG13 ' O ' ' A' ' 35' ' ' SER . 25.1 m -107.22 25.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.619 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.609 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -56.97 105.93 0.26 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.305 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.49 -9.32 58.94 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 28' ' ' VAL . . . -64.14 129.76 41.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.806 0.336 . . . . 0.0 110.517 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.63 -43.85 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.779 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 50.2 p30 -80.09 -23.36 41.33 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.834 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.6 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 79.68 1.81 87.32 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.627 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 75.4 p -90.98 135.67 33.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.625 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.599 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -77.6 110.46 13.31 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.101 -179.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.57 ' C ' HD12 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -108.86 -178.58 3.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.05 178.918 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.606 ' N ' HD12 ' A' ' 61' ' ' ILE . 2.8 p -58.58 -24.23 60.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.516 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -84.46 -48.37 9.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.229 178.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.677 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 60.3 mp0 -71.96 -20.81 61.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.581 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.57 ' O ' ' HG2' ' A' ' 45' ' ' MET . 10.0 tt -83.2 -49.28 9.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.951 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.552 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -60.15 -38.08 93.87 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.677 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.41 -58.22 4.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.731 0.3 . . . . 0.0 110.305 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.595 HG12 ' CE1' ' A' ' 27' ' ' PHE . 3.0 t -62.85 -32.09 54.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 89.6 mmm -60.19 -42.61 95.43 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.695 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 40.1 mtp180 -67.45 -32.04 72.63 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.453 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 26.8 mtm -59.53 -36.65 76.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.881 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.55 HD23 ' HB3' ' A' ' 156' ' ' ALA . 73.4 mt -88.59 -0.79 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.314 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.6 4.15 52.54 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.695 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 25.2 mm100 -90.34 135.27 33.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.972 0.415 . . . . 0.0 110.574 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.557 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 34.1 t-20 -134.11 60.99 48.29 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.544 ' HG2' ' CD2' ' A' ' 57' ' ' LEU . 60.2 Cg_endo -75.46 149.14 34.48 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.684 2.256 . . . . 0.0 112.41 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.623 ' OG1' ' OE1' ' A' ' 56' ' ' GLU . 62.6 p -81.64 161.68 60.65 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.056 0.455 . . . . 0.0 110.623 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -54.63 -39.36 89.14 Favored 'Trans proline' 0 C--N 1.303 -1.821 0 C-N-CA 122.71 2.273 . . . . 0.0 111.837 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -62.77 -50.49 70.85 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.154 0.502 . . . . 0.0 110.827 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.623 ' OE1' ' OG1' ' A' ' 53' ' ' THR . 21.9 mp0 -67.94 -39.68 83.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.841 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.708 ' HA ' ' SD ' ' A' ' 60' ' ' MET . 23.0 mt -62.09 -39.37 92.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.754 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.477 ' N ' HG23 ' A' ' 38' ' ' THR . 5.7 tt0 -59.43 -40.66 87.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.34 -49.33 76.01 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.026 0.441 . . . . 0.0 111.203 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.708 ' SD ' ' HA ' ' A' ' 57' ' ' LEU . 2.3 ptp -64.74 -35.16 80.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.489 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.614 HG13 ' O ' ' A' ' 57' ' ' LEU . 1.1 mt -62.63 -46.61 95.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.075 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.488 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 13.2 t70 -61.45 -30.22 70.44 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.53 ' CG ' ' NH1' ' A' ' 83' ' ' ARG . 5.3 tp10 -47.1 -37.14 9.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.283 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.467 HG12 HG11 ' A' ' 79' ' ' VAL . 1.5 m -114.52 -16.3 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.662 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.557 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 38.8 t70 -88.25 78.31 8.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.47 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.524 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 1.1 tt0 -72.77 -11.65 60.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.782 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.53 -12.13 60.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.532 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.29 14.07 68.38 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 85.7 p -85.1 -6.41 59.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 110.713 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.523 ' O ' HG23 ' A' ' 61' ' ' ILE . . . 71.51 17.88 76.66 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 0.9 OUTLIER -138.45 124.12 19.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.934 0.397 . . . . 0.0 110.76 -179.636 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.599 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -90.12 117.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.421 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.524 ' OD1' ' HG3' ' A' ' 76' ' ' GLU . 45.3 p-10 -82.26 -168.12 1.85 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.609 179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.6 ' C ' ' CD1' ' A' ' 74' ' ' PHE . 1.0 OUTLIER -56.84 -51.06 70.48 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.714 -179.521 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.67 -42.59 95.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.899 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.587 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 46.4 mt-10 -64.49 -42.05 96.09 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.109 0.48 . . . . 0.0 110.575 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.64 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -70.29 -43.19 70.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.797 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.616 HD22 ' CE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -52.92 -37.79 61.15 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.622 ' O ' HG11 ' A' ' 82' ' ' VAL . 39.7 t -61.56 -45.87 97.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.162 0.506 . . . . 0.0 110.42 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.692 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -53.6 -36.88 62.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.305 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.692 ' N ' ' HG2' ' A' ' 80' ' ' MET . 24.7 mmt -66.55 -50.0 64.6 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.198 0.523 . . . . 0.0 110.494 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.668 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER -68.43 -28.07 39.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.306 179.299 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.669 ' HG2' ' CD1' ' A' ' 5' ' ' TYR . 21.0 mtp180 -61.48 -46.41 90.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.505 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.1 m -75.65 -34.65 60.52 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.307 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.576 ' HG3' ' O ' ' A' ' 81' ' ' MET . 75.8 mtm -63.81 -41.35 97.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.95 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.577 ' O ' ' C ' ' A' ' 87' ' ' ASP . 0.1 OUTLIER -71.38 -42.67 68.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.698 -179.208 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.577 ' C ' ' O ' ' A' ' 86' ' ' LYS . 5.6 p-10 22.18 75.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.412 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.639 ' O ' ' C ' ' A' ' 89' ' ' SER . 99.1 m-20 -61.11 -40.14 92.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.731 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.639 ' C ' ' O ' ' A' ' 88' ' ' ASP . 23.5 m 8.54 -102.07 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 O-C-N 123.461 0.476 . . . . 0.0 110.707 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -129.83 -88.8 0.5 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.653 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.504 ' O ' ' HB2' ' A' ' 137' ' ' LYS . . . 74.31 -156.89 50.51 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 136' ' ' GLY . 0.0 OUTLIER 81.7 -88.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 110.655 -179.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -98.29 5.07 48.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.834 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.573 ' O ' ' O ' ' A' ' 140' ' ' ARG . 3.2 mmmt -125.34 62.28 1.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.511 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.573 ' O ' ' O ' ' A' ' 139' ' ' LYS . 5.2 ptp85 47.59 171.67 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.144 0.497 . . . . 0.0 110.46 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.708 ' O ' ' CB ' ' A' ' 142' ' ' THR . 23.3 Cg_exo -64.09 -51.36 2.23 Favored 'Trans proline' 0 C--N 1.302 -1.873 0 C-N-CA 122.886 2.39 . . . . 0.0 112.482 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.708 ' CB ' ' O ' ' A' ' 141' ' ' PRO . 2.5 m 137.16 154.26 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 123.782 0.676 . . . . 0.0 110.141 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.677 ' CB ' ' O ' ' A' ' 142' ' ' THR . 86.5 mt 101.11 130.2 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.14 0 O-C-N 123.992 0.807 . . . . 0.0 110.658 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 58.3 ttp85 -161.49 -52.63 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.306 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 13.5 mtp-105 -151.79 21.01 0.7 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.785 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . 0.549 ' O ' ' CD ' ' A' ' 147' ' ' ARG . 88.4 t -130.76 136.6 57.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.76 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.549 ' CD ' ' O ' ' A' ' 146' ' ' VAL . 0.0 OUTLIER 70.72 146.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.456 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 48' ' ' LEU . 18.7 tt -53.76 127.84 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.415 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.65 ' O ' ' CB ' ' A' ' 153' ' ' MET . 68.4 m -67.37 92.91 0.3 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.254 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -50.04 -34.09 20.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.514 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.527 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -62.17 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.229 0.537 . . . . 0.0 110.891 179.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -60.46 -30.92 69.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.554 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' MET . . . . . 0.65 ' CB ' ' O ' ' A' ' 149' ' ' SER . 2.3 ttt -50.96 -54.5 23.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.652 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' MET . . . . . 0.5 ' HE3' ' O ' ' A' ' 19' ' ' GLU . 1.9 mtp -65.77 -31.84 73.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.193 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.527 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.3 mt-30 -60.69 -41.47 95.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.882 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . 0.55 ' HB3' HD23 ' A' ' 48' ' ' LEU . . . -63.57 -39.89 95.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.095 0.474 . . . . 0.0 110.267 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -71.6 -48.08 50.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.27 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.406 HD21 ' HB1' ' A' ' 22' ' ' ALA . 91.9 mt -70.62 -40.07 73.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.777 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . 0.605 ' O ' ' CB ' ' A' ' 160' ' ' ALA . . . 83.95 12.83 76.21 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 111.051 -0.819 . . . . 0.0 111.051 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.605 ' CB ' ' O ' ' A' ' 159' ' ' GLY . . . 89.88 61.05 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.808 0.337 . . . . 0.0 110.631 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . 0.62 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 34.2 mtp180 -93.17 -171.6 2.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.53 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.62 ' CB ' ' O ' ' A' ' 161' ' ' ARG . . . 90.92 107.85 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.51 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -75.58 136.09 40.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.452 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.17 -166.23 53.68 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 1.5 t60 56.96 87.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.815 0.341 . . . . 0.0 110.62 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 167' ' ' HIS . 92.8 m-70 -61.78 -41.1 97.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.384 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . 0.421 ' HB2' ' O ' ' A' ' 166' ' ' HIS . 1.3 t60 173.58 -155.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.544 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.544 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 52.6 t-80 -101.57 23.14 11.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.552 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -156.9 168.07 28.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.566 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.449 179.814 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' V8Y . . . . . 0.532 ' O2 ' ' SD ' ' A' ' 60' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.577 HD13 ' C ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.644 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.0 m-30 -72.9 -29.33 63.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.606 178.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -59.02 -46.49 88.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.579 -0.896 . . . . 0.0 108.579 179.305 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.92 81.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.455 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.67 -40.88 80.39 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.6 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.035 HG22 HD12 ' A' ' 78' ' ' LEU . 75.4 t -62.48 -47.3 93.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.626 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.64 -24.76 66.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.648 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -70.47 -36.32 73.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.045 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 78' ' ' LEU . 57.6 mt -58.53 127.9 34.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.266 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 1.025 HG23 ' H ' ' A' ' 16' ' ' GLN . 4.4 t -61.87 171.37 1.68 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -60.69 -39.98 90.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.17 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -48.81 45.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 1.025 ' H ' HG23 ' A' ' 13' ' ' THR . 64.5 tt0 -62.61 -42.73 99.75 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.132 0.492 . . . . 0.0 110.585 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 32.3 ttmt -66.81 -35.24 79.61 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.689 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -59.34 -44.07 92.69 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.488 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -61.84 -44.78 96.14 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.402 0.62 . . . . 0.0 109.957 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.673 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 14.1 m-30 -64.45 -38.66 91.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.766 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 24' ' ' PHE . 24.7 tptm -59.09 -39.76 83.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.88 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.798 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -59.65 -42.62 93.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.845 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.54 -38.53 87.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.01 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.639 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 17.3 t80 -56.57 -49.56 74.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.607 ' O ' ' N ' ' A' ' 29' ' ' LEU . 61.6 t0 -62.27 -39.23 92.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.263 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.798 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.5 OUTLIER -56.4 -44.48 80.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.669 179.896 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.652 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 16.8 m-85 -62.17 -42.71 99.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.375 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.687 HG13 ' CG1' ' A' ' 36' ' ' ILE . 6.2 m -97.51 11.37 5.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.741 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.607 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -42.03 108.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.06 12.74 58.57 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.651 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -83.9 128.76 34.77 Favored 'General case' 0 C--N 1.331 -0.239 0 O-C-N 122.777 -0.249 . . . . 0.0 110.555 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -64.18 -40.73 96.72 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.701 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -21.96 25.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.565 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 81.35 -1.23 86.11 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.591 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 55.6 p -86.16 135.46 33.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.687 ' CG1' HG13 ' A' ' 28' ' ' VAL . 89.6 mt -76.87 105.65 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.106 0.479 . . . . 0.0 110.709 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.864 ' HB3' HG22 ' A' ' 71' ' ' THR . 60.3 p -103.33 177.49 4.83 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.701 HG22 ' C ' ' A' ' 57' ' ' LEU . 6.9 p -53.32 -39.59 64.15 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.043 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -66.47 -44.44 82.71 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.634 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 71.1 mm-40 -73.53 -20.69 60.58 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 109.956 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.609 ' O ' ' HG2' ' A' ' 45' ' ' MET . 0.4 OUTLIER -81.82 -47.37 12.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.54 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.504 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -60.94 -37.94 94.63 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.369 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.634 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -48.69 -57.29 6.51 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.203 0.502 . . . . 0.0 110.276 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.757 HG21 HG22 ' A' ' 26' ' ' ILE . 11.8 t -63.67 -35.63 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 CA-C-O 121.097 0.475 . . . . 0.0 110.019 177.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.609 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 87.5 mmm -59.06 -41.58 88.26 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.636 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 76.5 mtp85 -66.42 -33.16 75.08 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.556 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 20.5 mtm -59.75 -38.28 81.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.969 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.624 HD11 ' HG3' ' A' ' 153' ' ' MET . 79.3 mt -84.19 -1.87 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.857 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.41 8.77 52.25 Favored Glycine 0 CA--C 1.529 0.906 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.636 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 87.0 mm-40 -90.83 138.08 31.86 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.855 0.36 . . . . 0.0 111.078 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.599 ' ND2' ' O ' ' A' ' 51' ' ' ASN . 0.7 OUTLIER -127.38 60.89 46.1 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.81 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.652 ' HG2' HD11 ' A' ' 57' ' ' LEU . 81.7 Cg_endo -79.32 139.89 15.02 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.573 2.182 . . . . 0.0 112.169 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 73.8 p -74.25 152.31 88.09 Favored Pre-proline 0 CA--C 1.516 -0.34 0 CA-C-O 121.037 0.446 . . . . 0.0 110.323 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.13 -43.06 60.0 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 122.722 2.281 . . . . 0.0 112.294 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -62.74 -40.28 96.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.168 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.434 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 0.9 OUTLIER -78.84 -31.89 45.88 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.701 ' C ' HG22 ' A' ' 38' ' ' THR . 3.1 mt -60.96 -26.27 67.42 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.16 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.56 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 37.7 tt0 -58.93 -37.74 77.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.723 -178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -61.58 -41.28 97.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.158 0.504 . . . . 0.0 110.804 178.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.492 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 3.6 mmt -64.51 -42.02 96.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.763 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.562 HG21 ' O ' ' A' ' 70' ' ' GLY . 10.2 mm -61.62 -44.56 98.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.696 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.507 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 66.0 t0 -59.79 -29.91 68.53 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.33 -42.88 10.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.972 0.415 . . . . 0.0 110.338 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -113.2 -12.34 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.267 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.513 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 30.7 t70 -91.98 63.24 4.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.399 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -65.21 -21.0 66.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.821 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.488 ' OD2' ' OG ' ' A' ' 69' ' ' SER . 58.7 p-10 -74.67 -8.48 56.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.896 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.74 15.17 75.69 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.488 ' OG ' ' OD2' ' A' ' 67' ' ' ASP . 66.4 m -66.21 -26.74 67.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.927 0.394 . . . . 0.0 110.405 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.562 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 86.41 -1.14 87.34 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.864 HG22 ' HB3' ' A' ' 37' ' ' SER . 25.6 p -136.44 133.77 36.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.922 0.391 . . . . 0.0 110.926 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.732 HG22 ' O ' ' A' ' 72' ' ' VAL . 0.2 OUTLIER -100.48 103.82 15.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.217 0.532 . . . . 0.0 109.972 179.212 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.538 ' OD1' ' HA ' ' A' ' 35' ' ' SER . 18.1 m-20 -72.27 -163.9 0.13 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.302 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 1.02 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.4 t80 -57.86 -49.88 75.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.004 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.464 ' O ' HG23 ' A' ' 79' ' ' VAL . 97.3 m-20 -62.99 -42.29 99.8 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.017 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.534 ' CD ' ' HA ' ' A' ' 72' ' ' VAL . 45.5 mt-10 -64.38 -42.09 96.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.385 0.612 . . . . 0.0 111.132 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.713 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -71.33 -41.13 70.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.999 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.035 HD12 HG22 ' A' ' 9' ' ' VAL . 0.3 OUTLIER -58.39 -37.22 74.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.846 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 82' ' ' VAL . 42.1 t -60.69 -42.53 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 N-CA-C 109.335 -0.616 . . . . 0.0 109.335 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.454 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 1.0 OUTLIER -53.27 -43.53 67.5 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.916 -0.714 . . . . 0.0 110.083 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 24.7 mmt -60.83 -45.27 95.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.762 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.644 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.437 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.672 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.732 HG23 ' O ' ' A' ' 148' ' ' ILE . 20.8 tt . . . . . 0 C--O 1.231 0.12 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.635 ' O ' ' CB ' ' A' ' 153' ' ' MET . 66.3 m -42.21 96.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 148' ' ' ILE . . . -60.1 -39.1 84.99 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.326 0.391 . . . . 0.0 111.225 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.555 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 40.9 m-20 -50.88 -77.53 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.508 0.67 . . . . 0.0 110.811 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.6 -35.92 81.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.199 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.652 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 9.6 ttt -48.49 -53.78 16.73 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.382 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.845 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 2.0 mtp -65.93 -34.0 77.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.09 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.555 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 75.7 mt-30 -59.28 -43.28 92.53 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.62 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.441 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.32 -43.97 96.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -63.66 -41.02 98.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.482 -179.156 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.566 HD21 ' HB3' ' A' ' 22' ' ' ALA . 92.4 mt . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.545 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.629 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.191 0 CA-C-O 121.293 0.568 . . . . 0.0 109.855 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.649 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 21.6 m-30 -71.01 -29.05 64.89 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.616 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 1.4 mmpt? -58.93 -43.79 91.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.551 0.691 . . . . 0.0 109.282 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.63 -34.17 77.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.157 177.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.95 -41.41 82.77 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.611 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.675 HG13 ' HG ' ' A' ' 78' ' ' LEU . 72.2 t -62.24 -45.76 98.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.119 0.485 . . . . 0.0 109.705 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -70.06 -23.07 63.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.642 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.44 -33.74 67.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.536 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.587 HD12 HD11 ' A' ' 78' ' ' LEU . 13.9 mt -62.46 129.42 40.56 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.334 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.761 HG23 ' H ' ' A' ' 16' ' ' GLN . 2.6 t -69.64 -179.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.193 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 79.0 mm-40 -60.85 -45.03 96.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.138 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.85 -49.63 56.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.952 0.406 . . . . 0.0 111.454 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.761 ' H ' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -57.43 -51.31 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.273 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.65 -35.28 79.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.883 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.552 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.9 t-20 -60.04 -43.36 95.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.111 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.497 ' O ' ' CE ' ' A' ' 154' ' ' MET . 17.0 mt-10 -60.0 -51.06 71.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.353 179.348 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.667 ' CD2' ' SD ' ' A' ' 154' ' ' MET . 42.2 m-85 -62.69 -36.2 82.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.751 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.62 -41.3 85.6 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.767 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.67 -42.29 96.78 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.845 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.702 ' HB1' HD12 ' A' ' 157' ' ' LEU . . . -61.76 -39.14 90.58 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.041 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.762 ' O ' HG22 ' A' ' 28' ' ' VAL . 10.0 t80 -55.9 -49.75 72.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.391 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.419 ' O ' ' N ' ' A' ' 29' ' ' LEU . 38.7 t70 -62.45 -41.42 98.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.603 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.767 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -59.96 -42.45 89.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.291 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 1.102 ' CE1' HD11 ' A' ' 157' ' ' LEU . 5.6 m-85 -61.08 -39.42 89.85 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.33 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.762 HG22 ' O ' ' A' ' 24' ' ' PHE . 6.8 m -105.18 24.6 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.597 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -54.72 105.85 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.151 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.03 3.16 59.13 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.549 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -69.37 134.48 49.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 110.46 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -67.84 -42.03 82.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.526 ' O ' ' OD1' ' A' ' 33' ' ' ASP . 67.5 t0 -92.13 -20.83 20.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.389 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.703 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 88.48 -8.3 79.34 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.586 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.8 p -78.13 137.08 38.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.359 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.764 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.9 mt -75.82 107.86 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.893 0.378 . . . . 0.0 111.189 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.616 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 24.3 p -101.28 175.19 5.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.828 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.708 ' N ' HD11 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -55.66 -35.79 66.35 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.363 -179.393 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -71.86 -46.28 58.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.244 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.652 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . 33.1 mp0 -72.42 -20.93 61.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.826 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 45' ' ' MET . 1.1 tt -82.49 -48.97 10.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.932 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.541 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.57 -37.4 94.67 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.652 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.17 -57.53 4.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.376 -0.485 . . . . 0.0 110.121 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.718 HG11 ' CE1' ' A' ' 27' ' ' PHE . 11.3 t -62.68 -34.35 64.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.051 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . 1.007 ' SD ' HD12 ' A' ' 148' ' ' ILE . 91.3 mmm -58.59 -42.34 87.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 34.9 mtp-105 -66.57 -33.28 75.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 109.776 177.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.492 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 16.4 mtm -59.74 -37.08 77.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.865 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.819 HD21 ' HB3' ' A' ' 156' ' ' ALA . 69.7 mt -87.06 0.05 55.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.63 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.75 7.69 52.93 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.179 -0.769 . . . . 0.0 111.179 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.666 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 23.1 mm100 -96.06 131.94 41.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 110.831 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.464 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 40.2 t-20 -127.87 60.6 46.64 Favored Pre-proline 0 C--N 1.324 -0.542 0 C-N-CA 120.109 -0.636 . . . . 0.0 110.943 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.761 ' HG2' HD21 ' A' ' 57' ' ' LEU . 59.7 Cg_endo -76.72 138.35 18.93 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 C-N-CA 122.615 2.21 . . . . 0.0 112.355 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.1 p -72.06 154.06 92.5 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.0 110.502 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.98 -35.65 90.43 Favored 'Trans proline' 0 C--N 1.3 -1.996 0 C-N-CA 122.836 2.357 . . . . 0.0 111.705 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.88 -41.18 97.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.329 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.417 ' HB3' ' HE1' ' A' ' 60' ' ' MET . 2.8 mt-10 -81.26 -37.25 28.81 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.086 0.469 . . . . 0.0 110.418 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.761 HD21 ' HG2' ' A' ' 52' ' ' PRO . 52.4 mt -61.86 -31.24 71.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.525 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.529 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 46.5 tt0 -59.43 -42.33 91.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.989 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -67.0 -43.12 83.74 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.266 0.555 . . . . 0.0 110.557 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.524 ' HE2' ' HA ' ' A' ' 57' ' ' LEU . 3.4 mpp? -60.29 -38.52 83.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.34 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.708 HD11 ' N ' ' A' ' 38' ' ' THR . 1.1 mt -61.93 -46.83 95.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.024 0.44 . . . . 0.0 110.389 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.557 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 60.2 t0 -56.45 -26.7 54.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.396 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 60' ' ' MET . 8.9 tp10 -45.77 -37.65 6.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.068 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.866 HG21 ' SD ' ' A' ' 80' ' ' MET . 0.2 OUTLIER -119.96 -13.77 8.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.741 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.544 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 29.2 t70 -86.39 68.12 10.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.521 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -68.02 -17.17 64.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.67 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -12.66 60.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.62 -178.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.89 2.51 82.09 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.507 ' OG ' ' OD1' ' A' ' 65' ' ' ASP . 89.3 p -65.7 -18.24 65.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.838 0.351 . . . . 0.0 110.748 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.523 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 75.0 13.37 82.73 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.586 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.5 p -138.94 130.86 27.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.03 0.443 . . . . 0.0 110.802 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.764 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -96.45 112.8 29.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.917 179.483 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 14.0 p-10 -82.11 -165.83 1.1 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.371 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 1.017 ' HE1' HD23 ' A' ' 78' ' ' LEU . 2.1 t80 -57.08 -49.75 74.89 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.711 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -64.51 -44.22 91.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.778 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.497 ' OE1' ' HA ' ' A' ' 65' ' ' ASP . 54.8 mt-10 -64.9 -41.61 95.46 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.211 0.529 . . . . 0.0 110.477 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.703 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.53 -40.53 85.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.924 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.017 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -58.37 -38.95 78.3 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 82' ' ' VAL . 47.1 t -61.57 -40.01 85.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.895 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.866 ' SD ' HG21 ' A' ' 64' ' ' VAL . 32.4 mtm -58.36 -39.97 80.99 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 23.8 mmt -61.35 -43.86 98.15 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.011 0.434 . . . . 0.0 110.583 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.649 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.363 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 1.007 HD12 ' SD ' ' A' ' 45' ' ' MET . 21.1 tt . . . . . 0 N--CA 1.462 0.166 0 CA-C-O 120.853 0.359 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.622 ' O ' ' CB ' ' A' ' 153' ' ' MET . 45.0 t -36.41 107.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.925 -179.067 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.2 87.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.879 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.526 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 65.3 m-20 -55.43 -71.31 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.41 0.624 . . . . 0.0 110.669 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.498 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -62.31 -34.52 76.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.758 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.785 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 6.2 ttt -50.87 -48.92 60.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.449 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.667 ' SD ' ' CD2' ' A' ' 20' ' ' PHE . 1.8 mtp -70.75 -27.89 64.28 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.285 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 86.4 mt-30 -59.37 -45.67 90.8 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.156 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.819 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -75.98 -29.32 58.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.253 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 1.102 HD11 ' CE1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -60.27 -40.18 89.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.689 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' A' ' 22' ' ' ALA . 65.9 mt . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.988 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.579 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.328 0 CA-C-O 121.429 0.633 . . . . 0.0 109.527 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.628 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.5 m-30 -71.05 -31.8 68.34 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.373 0.606 . . . . 0.0 109.584 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -57.17 -45.03 84.03 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.017 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -63.98 -35.89 82.18 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.177 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -56.48 -40.38 74.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.641 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.744 HG13 ' HG ' ' A' ' 78' ' ' LEU . 79.7 t -62.07 -46.59 96.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.69 -24.35 63.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.628 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 23.5 mm100 -70.38 -36.94 74.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.635 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.872 HD12 HD11 ' A' ' 78' ' ' LEU . 23.4 mt -59.9 110.35 1.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.498 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.712 HG23 ' H ' ' A' ' 16' ' ' GLN . 5.0 t -53.92 177.88 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.186 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 24.0 pt-20 -56.98 -37.48 71.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.694 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 79.3 tt0 -75.4 -46.93 29.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.197 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.712 ' H ' HG23 ' A' ' 13' ' ' THR . 14.1 mt-30 -59.85 -48.51 81.39 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.794 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.462 ' CG ' ' HZ ' ' A' ' 74' ' ' PHE . 26.1 ttmt -65.6 -33.36 75.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 66.6 t30 -60.55 -43.44 97.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.292 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.544 ' O ' ' HE3' ' A' ' 154' ' ' MET . 1.1 tt0 -62.05 -51.78 66.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.408 0.623 . . . . 0.0 109.905 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.679 ' CD1' HD13 ' A' ' 12' ' ' LEU . 68.7 m-85 -65.31 -37.76 88.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.053 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -58.01 -40.8 81.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.737 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 1.046 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -61.01 -41.83 97.29 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.99 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -60.05 -38.6 83.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.052 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.861 ' O ' HG22 ' A' ' 28' ' ' VAL . 41.6 t80 -57.37 -48.83 78.02 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.553 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 29' ' ' LEU . 67.0 t0 -61.55 -41.3 97.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.312 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 1.046 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -59.54 -45.38 93.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.535 179.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.751 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 16.0 m-85 -61.13 -40.54 94.18 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.353 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.861 HG22 ' O ' ' A' ' 24' ' ' PHE . 15.0 m -104.27 23.82 2.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.419 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.613 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -52.67 106.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 -179.61 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.34 7.01 67.9 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.539 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -65.52 135.59 55.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.743 0.306 . . . . 0.0 110.389 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.99 -41.39 95.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.175 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.3 p30 -96.91 -19.6 18.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.845 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.631 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 86.97 -8.62 75.57 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.6 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 54.6 p -80.91 136.42 36.05 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.745 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.5 mt -72.94 104.75 2.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.834 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.625 ' HB3' HG22 ' A' ' 71' ' ' THR . 87.2 p -99.79 159.96 14.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.549 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.751 ' N ' HD11 ' A' ' 61' ' ' ILE . 1.3 p -41.57 -32.59 0.37 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.35 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -74.73 -43.42 55.09 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.172 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.653 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . 4.8 mm-40 -74.49 -21.97 59.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.344 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.601 HD22 HD22 ' A' ' 57' ' ' LEU . 3.4 tt -83.32 -50.15 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.839 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.529 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.48 -37.13 94.18 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.653 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -46.4 -59.89 2.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 117.236 0.518 . . . . 0.0 109.986 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.751 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 9.6 t -62.03 -34.09 61.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . 1.02 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.5 mmm -58.5 -43.31 89.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.009 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.618 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 21.7 mtt180 -67.24 -32.48 73.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.192 0.52 . . . . 0.0 109.73 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.616 ' HE1' HG22 ' A' ' 44' ' ' VAL . 26.0 mtm -60.79 -37.18 81.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.063 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.678 HD13 ' HA ' ' A' ' 153' ' ' MET . 57.3 mt -89.79 3.84 51.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.537 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.6 -3.62 57.74 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.618 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 8.2 mm100 -85.31 129.52 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.787 0.327 . . . . 0.0 111.137 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -129.19 61.44 57.14 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.906 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.748 ' CG ' HD21 ' A' ' 57' ' ' LEU . 58.7 Cg_endo -73.8 143.86 34.07 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 C-N-CA 122.542 2.161 . . . . 0.0 112.29 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.4 p -73.63 156.98 88.19 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 121.202 0.525 . . . . 0.0 110.551 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.85 -40.24 73.98 Favored 'Trans proline' 0 C--N 1.299 -2.059 0 C-N-CA 122.791 2.327 . . . . 0.0 112.017 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 52.5 mp0 -62.69 -40.4 97.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.391 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 60' ' ' MET . 1.6 tp10 -78.52 -37.77 42.27 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.44 0.638 . . . . 0.0 109.788 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.748 HD21 ' CG ' ' A' ' 52' ' ' PRO . 33.0 mt -61.05 -35.65 77.48 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.476 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -41.77 88.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.403 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -63.47 -41.67 98.59 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 110.028 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.502 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -65.14 -40.99 95.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.751 HD11 ' N ' ' A' ' 38' ' ' THR . 2.6 mt -61.61 -47.09 94.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.803 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.628 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 39.1 t70 -60.28 -29.37 68.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.719 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -54.23 -38.18 65.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.208 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.509 HG11 ' HB2' ' A' ' 80' ' ' MET . 2.2 m -110.51 0.86 9.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.044 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.628 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 57.3 t0 -85.2 109.21 18.15 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.128 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.48 -49.09 72.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.982 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.555 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 51.8 p30 -89.34 -6.18 56.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.755 0.312 . . . . 0.0 110.673 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.447 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 65.66 27.04 72.25 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.615 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.1 p -68.52 4.22 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.858 0.361 . . . . 0.0 110.73 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.55 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.77 16.08 80.48 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.625 HG22 ' HB3' ' A' ' 37' ' ' SER . 4.6 p -141.31 128.91 21.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.745 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -98.95 103.91 15.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.448 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.59 ' OD1' ' CB ' ' A' ' 35' ' ' SER . 66.4 m-20 -74.58 -164.96 0.31 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.39 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 1.001 ' HE1' HD23 ' A' ' 78' ' ' LEU . 4.4 t80 -57.21 -48.48 78.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.63 -48.39 75.05 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.784 0.326 . . . . 0.0 110.823 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.615 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 52.5 mt-10 -62.36 -41.68 98.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.289 0.566 . . . . 0.0 110.463 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.731 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.51 -41.15 84.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.057 0.456 . . . . 0.0 109.823 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.001 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -56.07 -40.65 73.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.595 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.556 ' O ' HG13 ' A' ' 82' ' ' VAL . 43.9 t -61.08 -42.62 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.509 ' HB2' HG11 ' A' ' 64' ' ' VAL . 4.3 ttm -52.22 -44.77 64.99 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.6 mmt -60.28 -46.3 90.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.998 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.628 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.653 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 1.02 HD12 ' SD ' ' A' ' 45' ' ' MET . 19.3 tt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 121.195 0.521 . . . . 0.0 110.366 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.578 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -34.54 107.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.278 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.471 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.73 -39.19 83.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -43.28 -84.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.346 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.435 ' HA ' ' HB2' ' A' ' 155' ' ' GLN . . . -61.19 -33.91 74.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.226 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.679 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 6.3 ttt -48.22 -49.78 31.78 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.288 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.99 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 3.6 mtp -76.42 -27.04 56.13 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.534 179.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 76.0 mt-30 -60.37 -43.19 96.81 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.338 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.627 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -64.1 -44.68 91.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.024 0.44 . . . . 0.0 110.682 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.633 ' N ' HD23 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -62.46 -43.17 99.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.582 -179.287 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.729 HD21 ' HB3' ' A' ' 22' ' ' ALA . 90.1 mt . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.231 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.582 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.205 0.526 . . . . 0.0 109.651 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.6 m-30 -71.29 -29.69 65.36 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.73 -45.73 88.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.07 -34.56 78.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.288 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -58.12 -40.83 82.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.847 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.873 HG22 HD12 ' A' ' 78' ' ' LEU . 94.0 t -62.87 -45.52 98.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -69.94 -26.98 64.39 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.412 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 12.1 mm100 -69.57 -37.9 77.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.588 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.738 HD12 HD11 ' A' ' 78' ' ' LEU . 20.2 mt -56.36 128.49 36.16 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.281 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.727 HG23 ' H ' ' A' ' 16' ' ' GLN . 9.0 t -63.65 179.4 0.48 Allowed 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.092 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -61.4 -41.1 96.6 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.464 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -69.93 -42.12 73.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.84 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.727 ' H ' HG23 ' A' ' 13' ' ' THR . 71.4 mt-30 -61.89 -43.5 98.72 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 5.8 mtmt -71.96 -30.18 65.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.813 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -62.2 -49.05 77.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.227 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.583 ' O ' ' CE ' ' A' ' 154' ' ' MET . 64.4 mt-10 -63.14 -44.72 94.77 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.418 0.627 . . . . 0.0 110.37 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.65 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 39.0 m-85 -67.74 -37.07 81.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.674 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 29.1 tptp -60.78 -40.32 92.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.846 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 1.04 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.01 -42.97 95.45 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.76 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.851 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.07 -39.62 90.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.825 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.654 ' O ' HG22 ' A' ' 28' ' ' VAL . 16.3 t80 -56.65 -48.8 76.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.645 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 29' ' ' LEU . 6.3 t70 -61.72 -41.67 97.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.827 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 1.04 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.26 -44.46 83.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.667 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.984 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 21.3 m-85 -61.92 -40.96 97.27 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.342 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.693 HG13 HG12 ' A' ' 36' ' ' ILE . 31.4 m -106.46 25.38 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.458 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.764 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -54.0 111.17 0.7 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.253 -179.519 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.84 3.06 83.67 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.511 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -62.66 136.6 57.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.353 . . . . 0.0 110.301 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 61.9 mp0 -64.81 -40.31 94.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.459 ' OD1' ' HB3' ' A' ' 35' ' ' SER . 11.0 t70 -96.98 -22.81 16.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.741 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.646 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 89.07 -8.85 78.88 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.592 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 81.4 p -79.69 136.46 36.79 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.759 ' HB ' HG13 ' A' ' 72' ' ' VAL . 94.6 mt -73.77 104.15 2.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.551 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 83.5 p -97.01 168.09 10.67 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.073 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.777 HG22 ' HB3' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -49.16 -38.21 24.83 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.552 -179.471 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.45 -49.17 57.53 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.133 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.551 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 1.4 mp0 -64.51 -43.83 92.83 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.07 0.462 . . . . 0.0 110.743 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.726 HD22 ' HE1' ' A' ' 60' ' ' MET . 4.0 tt -64.98 -49.81 68.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.133 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.58 -31.83 79.17 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.118 -1.193 . . . . 0.0 110.118 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.519 ' HE3' ' O ' ' A' ' 26' ' ' ILE . 0.0 OUTLIER -54.33 -54.05 45.56 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 1.032 HG22 ' SD ' ' A' ' 47' ' ' MET . 1.1 t -66.1 -32.22 57.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.975 ' SD ' HD12 ' A' ' 148' ' ' ILE . 89.5 mmm -59.18 -43.38 92.19 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 78.5 mtp85 -66.98 -37.85 84.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.703 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' MET . . . . . 1.032 ' SD ' HG22 ' A' ' 44' ' ' VAL . 1.3 ptm -55.08 -29.15 56.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.488 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 148' ' ' ILE . 32.0 mt -94.79 0.02 54.56 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.808 -179.486 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.42 5.64 54.02 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.708 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 14.8 mm100 -88.86 135.68 33.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.926 0.393 . . . . 0.0 111.242 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.53 ' ND2' HH12 ' A' ' 46' ' ' ARG . 51.4 t-20 -128.67 60.45 49.25 Favored Pre-proline 0 C--N 1.32 -0.705 0 C-N-CA 119.474 -0.891 . . . . 0.0 111.089 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.765 ' HG2' HD11 ' A' ' 57' ' ' LEU . 71.6 Cg_endo -77.05 144.69 24.04 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 C-N-CA 122.659 2.239 . . . . 0.0 112.471 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 p -80.68 153.53 73.2 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.101 0.477 . . . . 0.0 110.458 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.31 -36.69 94.19 Favored 'Trans proline' 0 C--N 1.3 -2.0 0 C-N-CA 122.792 2.328 . . . . 0.0 111.978 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.4 mp0 -62.45 -39.87 94.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.433 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -81.96 -34.42 29.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.908 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.777 ' HB3' HG22 ' A' ' 38' ' ' THR . 32.6 mt -64.93 -39.24 93.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.851 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.501 ' N ' ' CG2' ' A' ' 38' ' ' THR . 7.1 mt-30 -53.53 -50.18 66.02 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.839 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -62.92 -44.05 97.12 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.582 0.706 . . . . 0.0 109.953 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.726 ' HE1' HD22 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -58.52 -42.91 88.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.134 179.104 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.732 HD11 ' N ' ' A' ' 38' ' ' THR . 3.2 mt -60.61 -47.72 91.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.971 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.649 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 18.7 t70 -56.54 -22.31 32.27 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.578 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' MET . 51.6 tp10 -49.97 -39.54 41.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.531 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -115.1 -4.97 11.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.911 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.649 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 53.4 t0 -72.04 114.81 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.602 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -64.63 -46.5 82.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.58 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 59.5 p30 -94.06 -6.27 45.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.868 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 70' ' ' GLY . . . 68.12 23.1 74.61 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.612 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.4 p -69.61 5.72 1.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.836 0.35 . . . . 0.0 110.699 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.683 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.68 17.52 80.0 Favored Glycine 0 CA--C 1.518 0.257 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.592 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.1 p -138.71 122.37 17.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.922 0.392 . . . . 0.0 111.106 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.759 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -99.97 106.19 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.195 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.7 m-20 -73.62 -166.79 0.39 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.507 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.979 ' HE1' HD23 ' A' ' 78' ' ' LEU . 0.8 OUTLIER -57.85 -51.09 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.248 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -63.14 -43.51 98.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.859 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.635 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 68.6 mt-10 -64.62 -39.04 93.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.672 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -72.35 -39.18 68.3 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.198 0.523 . . . . 0.0 110.279 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.979 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.7 -36.58 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -179.352 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.637 ' O ' HG13 ' A' ' 82' ' ' VAL . 48.8 t -59.95 -40.43 82.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.315 0.578 . . . . 0.0 109.732 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.425 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 9.5 ttt -57.2 -43.09 82.4 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.857 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.425 ' HG3' ' CD2' ' A' ' 20' ' ' PHE . 38.8 mmt -60.19 -47.5 85.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.113 0.482 . . . . 0.0 110.547 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.657 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.377 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.975 HD12 ' SD ' ' A' ' 45' ' ' MET . 15.9 tt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.741 0.305 . . . . 0.0 110.346 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.504 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.7 OUTLIER -38.49 102.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.249 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.473 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.66 -39.64 89.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.725 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 3.5 t0 -45.89 -79.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.134 0.492 . . . . 0.0 110.659 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.53 77.36 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.762 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.599 ' O ' ' HG ' ' A' ' 157' ' ' LEU . 11.0 ttt -48.0 -51.6 23.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.323 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.851 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.6 mtp -70.44 -30.16 66.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.363 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 73.4 mt-30 -60.8 -42.54 97.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.022 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.448 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -64.02 -43.79 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.486 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.806 HD22 HG21 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -66.49 -42.79 86.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.675 -179.32 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.502 HD21 ' HB3' ' A' ' 22' ' ' ALA . 75.1 mt . . . . . 0 C--N 1.326 -0.423 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.194 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.597 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.206 0 CA-C-O 121.422 0.63 . . . . 0.0 110.098 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.626 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.9 m-30 -70.3 -32.04 69.64 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -44.02 85.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.491 0.662 . . . . 0.0 109.223 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.78 76.73 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.255 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.86 -40.33 79.92 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.867 HG13 ' HG ' ' A' ' 78' ' ' LEU . 83.8 t -62.84 -45.36 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.42 -23.81 62.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.395 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.38 -34.63 70.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.842 -179.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.782 HD13 ' CE1' ' A' ' 20' ' ' PHE . 15.7 mt -61.55 123.99 19.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.575 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.648 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -60.88 -179.14 0.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.659 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.534 ' N ' ' OG1' ' A' ' 13' ' ' THR . 49.3 tp10 -60.34 -48.37 82.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.892 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -65.69 -43.25 89.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.012 0.434 . . . . 0.0 110.847 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.648 ' H ' HG23 ' A' ' 13' ' ' THR . 15.8 mt-30 -58.17 -50.83 72.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.748 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HD3' ' HZ ' ' A' ' 74' ' ' PHE . 21.3 ttmt -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.955 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -61.11 -46.32 91.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.082 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.478 ' O ' ' HE3' ' A' ' 154' ' ' MET . 0.4 OUTLIER -64.64 -46.08 84.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.487 0.661 . . . . 0.0 110.168 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.782 ' CE1' HD13 ' A' ' 12' ' ' LEU . 43.8 m-85 -62.34 -37.11 84.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.735 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.414 ' NZ ' ' HB2' ' A' ' 74' ' ' PHE . 57.8 tptt -58.56 -38.89 78.81 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 1.078 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.32 -41.56 93.78 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.962 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.67 -38.71 88.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.851 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.866 ' O ' HG22 ' A' ' 28' ' ' VAL . 14.1 t80 -58.29 -49.27 77.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.768 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' A' ' 29' ' ' LEU . 57.4 t0 -61.97 -40.79 96.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 1.078 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -57.91 -44.78 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.812 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.849 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 16.7 m-85 -63.46 -38.12 89.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.049 0.452 . . . . 0.0 110.504 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.866 HG22 ' O ' ' A' ' 24' ' ' PHE . 6.9 m -104.71 21.09 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.684 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.546 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -55.76 101.76 0.06 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.384 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.88 5.06 54.05 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.42 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -69.14 139.17 54.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.682 0.277 . . . . 0.0 110.62 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -66.79 -42.33 86.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.305 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.488 ' OD2' ' OG ' ' A' ' 35' ' ' SER . 56.4 p-10 -99.98 -15.49 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.861 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 89.28 -8.63 79.41 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.621 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 52.7 p -75.73 135.47 40.35 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.829 ' CG1' HG13 ' A' ' 28' ' ' VAL . 85.4 mt -74.71 106.22 4.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.612 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 38.7 t -101.26 157.87 16.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.068 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.656 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -39.16 -43.53 1.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.53 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.11 -41.75 90.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 110.361 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.624 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 6.9 mp0 -75.8 -21.7 57.08 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.454 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.603 ' O ' ' HG2' ' A' ' 45' ' ' MET . 2.6 tt -83.84 -47.94 10.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.842 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.542 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.09 -38.99 96.49 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.624 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.74 -57.87 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.152 0.501 . . . . 0.0 110.283 179.347 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.746 HG11 ' CE1' ' A' ' 27' ' ' PHE . 37.1 t -62.56 -35.02 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.056 177.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.603 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 90.5 mmm -56.53 -43.18 79.58 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.748 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 50.9 mtp180 -64.44 -35.49 81.1 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.074 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.512 ' HE2' ' HA ' ' A' ' 44' ' ' VAL . 19.1 mtm -60.32 -28.59 68.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.116 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.648 HD21 ' HB3' ' A' ' 156' ' ' ALA . 24.7 mt -95.81 5.56 51.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.222 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 95.73 -2.14 64.24 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.592 -1.003 . . . . 0.0 110.592 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.748 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -84.76 135.93 33.92 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 110.869 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.456 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 24.1 p30 -129.97 58.83 40.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.223 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.537 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 65.8 Cg_endo -80.33 146.54 17.6 Favored 'Trans proline' 0 C--N 1.304 -1.808 0 C-N-CA 122.787 2.325 . . . . 0.0 111.926 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 p -80.02 153.08 74.79 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.62 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.23 -40.8 79.8 Favored 'Trans proline' 0 C--N 1.301 -1.93 0 C-N-CA 122.839 2.359 . . . . 0.0 112.081 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.5 mp0 -62.49 -39.32 93.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.29 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.512 ' O ' ' HE1' ' A' ' 60' ' ' MET . 0.2 OUTLIER -80.54 -34.14 35.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.42 179.65 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.586 ' HB3' HG22 ' A' ' 38' ' ' THR . 16.3 mt -62.04 -29.48 70.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.713 179.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.44 -36.4 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.46 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -62.27 -48.75 78.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 0.0 110.901 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.658 ' N ' ' SD ' ' A' ' 60' ' ' MET . 2.0 mpp? -63.53 -39.48 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.524 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.656 HD11 ' N ' ' A' ' 38' ' ' THR . 1.5 mt -61.96 -44.74 99.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.193 0.52 . . . . 0.0 110.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.561 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.9 t70 -59.01 -35.48 73.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.587 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -51.5 -42.46 61.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.684 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.427 HG11 ' HB2' ' A' ' 80' ' ' MET . 3.1 m -106.63 3.54 10.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.681 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.561 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 34.5 t70 -107.74 90.34 3.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.366 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -79.57 -19.18 50.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.37 -11.95 60.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.643 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.48 19.09 68.48 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.0 p -86.32 -7.9 58.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.832 0.348 . . . . 0.0 110.875 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.555 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 74.06 17.45 79.48 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.626 -0.989 . . . . 0.0 110.626 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.621 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.1 p -137.48 128.59 27.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.044 0.449 . . . . 0.0 110.613 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.806 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -97.58 105.43 17.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.503 179.649 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.0 m-20 -74.11 -161.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.69 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 1.034 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.7 t80 -58.79 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.874 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.62 -42.48 98.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.632 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.557 ' C ' HG23 ' A' ' 72' ' ' VAL . 48.0 mt-10 -66.37 -41.38 89.53 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.311 0.577 . . . . 0.0 110.577 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.784 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.85 -37.83 82.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.936 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.034 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -59.1 -40.68 86.06 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.692 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.591 ' O ' HG13 ' A' ' 82' ' ' VAL . 53.8 t -62.15 -39.21 83.09 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.094 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.587 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.485 ' HE3' ' HA ' ' A' ' 77' ' ' PHE . 1.4 ttm -57.02 -42.99 81.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.249 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.49 ' HE3' ' HE1' ' A' ' 77' ' ' PHE . 22.1 mmt -60.51 -45.38 94.0 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.035 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.636 HG12 ' O ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.494 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.601 HG22 ' O ' ' A' ' 148' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.684 0.278 . . . . 0.0 110.483 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.62 ' O ' ' CB ' ' A' ' 153' ' ' MET . 12.5 m -87.95 102.2 14.5 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -52.48 -34.99 51.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.413 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 16.2 t0 -56.79 -80.07 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.231 0.539 . . . . 0.0 110.456 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.554 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -61.57 -34.36 75.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.849 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 4.9 ttt -45.64 -61.45 1.7 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.073 0.463 . . . . 0.0 110.252 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.962 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 6.5 mtp -63.91 -28.19 69.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.185 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 72.8 mt-30 -60.75 -40.64 93.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.194 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.648 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -65.0 -39.92 94.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.392 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.768 ' CB ' HD13 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -73.89 -46.47 44.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.583 -179.494 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 154' ' ' MET . 83.9 mt . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.828 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.622 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.09 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.629 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.9 m-30 -71.66 -31.86 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -46.09 82.91 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.538 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.4 -35.61 81.45 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.551 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -57.32 -40.37 77.78 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.831 HG22 HD12 ' A' ' 78' ' ' LEU . 92.3 t -61.07 -47.14 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -69.12 -30.65 68.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.095 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 92.4 mm-40 -69.4 -36.56 76.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.924 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.81 HD12 HD11 ' A' ' 78' ' ' LEU . 13.5 mt -51.4 125.37 14.18 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.797 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.937 HG23 ' H ' ' A' ' 16' ' ' GLN . 9.9 t -60.66 167.9 2.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.259 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.538 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.8 tm-20 -60.08 -42.27 94.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.777 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -70.8 -50.7 32.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.163 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.937 ' H ' HG23 ' A' ' 13' ' ' THR . 5.9 tt0 -61.89 -44.76 96.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.143 0.497 . . . . 0.0 110.333 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -66.56 -33.43 75.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.773 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.538 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 65.0 t30 -58.25 -42.58 86.71 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.99 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -62.67 -45.48 92.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.032 0.444 . . . . 0.0 110.051 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.655 ' HD1' HD13 ' A' ' 12' ' ' LEU . 12.8 m-85 -64.81 -38.98 92.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.343 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.7 tptp -59.68 -40.93 89.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.727 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.944 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.79 -41.77 96.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.83 -38.76 89.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.004 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.746 ' O ' HG22 ' A' ' 28' ' ' VAL . 23.2 t80 -57.4 -49.13 77.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.649 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.542 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.42 -39.16 92.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.384 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.944 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -57.06 -47.44 83.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.627 -179.772 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.904 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 25.4 m-85 -61.88 -42.27 98.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.494 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.746 HG22 ' O ' ' A' ' 24' ' ' PHE . 18.9 m -101.2 22.91 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.657 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.582 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -57.75 100.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.408 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.97 -5.58 53.45 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.458 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -60.17 138.24 57.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.835 0.35 . . . . 0.0 110.514 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.87 -41.21 91.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.996 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.66 -22.97 19.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.778 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.684 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 89.0 -9.38 77.02 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.598 ' C ' HG11 ' A' ' 28' ' ' VAL . 89.3 p -82.72 136.2 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.681 ' CG1' HG13 ' A' ' 28' ' ' VAL . 96.4 mt -69.05 104.8 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.597 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.613 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 8.9 p -98.63 156.33 16.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.715 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -39.48 -38.48 0.58 Allowed 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.481 -179.277 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.76 -46.06 76.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.976 0.417 . . . . 0.0 110.171 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.613 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 6.7 mp0 -68.75 -39.42 80.3 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.644 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.945 HD22 HD22 ' A' ' 57' ' ' LEU . 6.4 tt -60.5 -49.05 79.09 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.444 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.578 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.09 -36.27 92.69 Favored Glycine 0 CA--C 1.531 1.033 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -51.23 -62.93 1.32 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.039 0.447 . . . . 0.0 109.99 179.596 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.904 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 4.7 t -58.8 -30.88 43.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.903 178.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.689 ' HE3' ' CG ' ' A' ' 52' ' ' PRO . 81.4 mmm -59.18 -41.99 89.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.281 -0.418 . . . . 0.0 109.874 179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.695 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 77.1 mtp180 -67.61 -31.26 71.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.031 0.443 . . . . 0.0 109.847 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 44' ' ' VAL . 19.8 mtm -61.59 -35.96 79.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.098 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.692 ' CD2' ' HB3' ' A' ' 156' ' ' ALA . 11.0 mt -90.3 2.64 55.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.568 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.69 -1.0 56.72 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.695 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 28.1 mm100 -86.0 134.72 33.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.855 0.359 . . . . 0.0 110.855 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.605 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 31.8 p30 -131.41 60.1 50.17 Favored Pre-proline 0 C--N 1.326 -0.429 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.4 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.689 ' CG ' ' HE3' ' A' ' 45' ' ' MET . 3.6 Cg_exo -75.9 157.83 38.85 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 C-N-CA 123.519 2.812 . . . . 0.0 112.124 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.4 p -89.28 154.2 48.95 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.03 0.443 . . . . 0.0 110.389 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.61 -42.02 71.92 Favored 'Trans proline' 0 C--N 1.302 -1.916 0 C-N-CA 122.716 2.277 . . . . 0.0 112.031 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.16 -44.76 95.89 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.887 0.375 . . . . 0.0 110.262 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.592 ' O ' ' SD ' ' A' ' 60' ' ' MET . 54.2 tp10 -71.64 -38.53 70.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.167 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.945 HD22 HD22 ' A' ' 41' ' ' LEU . 41.9 mt -60.62 -24.11 65.25 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.759 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.435 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 34.9 tt0 -64.3 -39.9 94.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.827 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -61.1 -44.14 97.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.108 0.48 . . . . 0.0 110.758 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -67.53 -39.67 85.05 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.346 179.585 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.715 HD11 ' N ' ' A' ' 38' ' ' THR . 1.4 mt -61.52 -46.06 97.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.439 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 38.2 t70 -59.19 -37.45 77.46 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.589 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.4 tt0 -47.44 -35.03 7.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.543 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 2.5 m -118.51 6.11 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.682 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.455 ' OD2' ' N ' ' A' ' 70' ' ' GLY . 59.0 t0 -117.08 83.24 1.94 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.06 -17.42 63.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 -13.0 60.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.522 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.22 13.68 60.47 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.3 p -76.58 -12.54 60.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.698 0.285 . . . . 0.0 110.995 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.605 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 75.02 16.29 80.65 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.577 ' HA ' ' O ' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -134.48 115.24 13.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.978 0.418 . . . . 0.0 111.101 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.821 HG23 ' N ' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -90.58 105.55 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.199 179.311 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.539 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -72.69 -162.97 0.11 Allowed 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.65 179.678 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.887 ' HE1' HD23 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -58.1 -51.41 69.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.811 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.474 ' O ' HG23 ' A' ' 79' ' ' VAL . 1.2 p30 -65.33 -42.27 93.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.711 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.578 ' O ' ' HB ' ' A' ' 64' ' ' VAL . 53.0 mt-10 -62.36 -42.24 99.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.451 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.821 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -73.89 -42.86 60.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.127 0.489 . . . . 0.0 110.142 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.887 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.11 -34.77 45.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.732 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 82' ' ' VAL . 46.4 t -60.58 -44.06 95.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.002 178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.635 ' HE3' ' CA ' ' A' ' 77' ' ' PHE . 5.2 ptp -56.97 -40.1 75.87 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.053 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.549 ' HE2' ' HG3' ' A' ' 80' ' ' MET . 35.2 mmt -61.55 -45.43 94.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.146 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.213 179.158 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.766 HD11 ' HG3' ' A' ' 153' ' ' MET . 20.7 tt . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.763 0.316 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.646 ' O ' ' CB ' ' A' ' 153' ' ' MET . 43.0 m -76.17 84.07 3.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -44.28 -37.64 3.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.61 -88.24 0.0 OUTLIER 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.261 0.553 . . . . 0.0 110.907 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.13 -25.95 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.759 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.766 ' HG3' HD11 ' A' ' 148' ' ' ILE . 0.0 OUTLIER -52.36 -49.87 63.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.454 179.754 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.824 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.9 mtp -69.74 -31.47 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.479 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -60.23 -41.87 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.313 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.692 ' HB3' ' CD2' ' A' ' 48' ' ' LEU . . . -65.76 -43.66 88.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.033 0.444 . . . . 0.0 110.966 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.662 ' HB3' HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -63.24 -44.63 94.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.577 -179.433 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 22' ' ' ALA . 83.2 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.221 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.634 HG23 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.382 0 CA-C-O 121.37 0.605 . . . . 0.0 109.476 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.634 ' CD2' HG23 ' A' ' 4' ' ' ILE . 21.0 m-30 -71.88 -30.25 65.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.577 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.2 mmpt? -57.56 -46.11 84.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.553 0.692 . . . . 0.0 109.194 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.484 ' O ' ' HG3' ' A' ' 11' ' ' GLN . . . -63.87 -35.28 80.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.157 177.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.37 -40.95 79.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.663 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.744 HG22 HD12 ' A' ' 78' ' ' LEU . 75.7 t -62.9 -46.28 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -73.6 -20.42 60.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.038 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 7' ' ' ALA . 2.8 mt-30 -71.06 -36.25 72.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.86 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.721 HD13 ' CD1' ' A' ' 20' ' ' PHE . 31.3 mt -56.41 128.01 33.86 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.949 HG23 ' H ' ' A' ' 16' ' ' GLN . 7.5 t -60.67 167.7 2.58 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.959 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -55.42 -39.75 70.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.835 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -74.18 -46.84 39.57 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.745 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.949 ' H ' HG23 ' A' ' 13' ' ' THR . 65.5 tt0 -62.68 -43.97 97.45 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.964 0.411 . . . . 0.0 110.588 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 30.8 ttmt -65.61 -35.55 81.14 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -60.51 -43.71 96.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.853 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.496 ' HG2' HD11 ' A' ' 158' ' ' LEU . 8.7 tt0 -62.66 -46.5 87.91 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.721 ' CD1' HD13 ' A' ' 12' ' ' LEU . 23.5 m-85 -65.07 -39.45 93.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.876 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -59.36 -39.94 84.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.747 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 1.015 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.03 -41.27 91.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.71 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.859 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -60.69 -39.73 89.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.999 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.661 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 29.8 t80 -57.8 -48.91 78.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.846 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 29' ' ' LEU . 47.8 t0 -63.01 -39.23 94.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 1.015 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.8 OUTLIER -57.37 -44.28 83.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.748 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.935 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 14.4 m-85 -61.85 -42.13 98.67 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.056 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.788 HG11 ' O ' ' A' ' 34' ' ' GLY . 6.6 m -101.29 25.14 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.746 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB3' ' HZ1' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -56.28 107.59 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.262 -179.642 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.63 6.15 80.73 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.454 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -64.52 139.42 58.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.547 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -64.24 -41.88 96.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.991 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.51 -22.35 17.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.643 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.788 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 88.02 -8.52 77.9 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.65 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 92.1 p -83.44 136.99 34.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.342 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.639 ' HB ' HG13 ' A' ' 72' ' ' VAL . 97.5 mt -73.45 106.71 3.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.172 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.599 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 32.5 p -102.17 -175.1 2.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.152 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.915 HG23 HD12 ' A' ' 61' ' ' ILE . 6.4 p -64.19 -30.32 71.39 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.442 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.6 mmtt -72.58 -50.53 24.84 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.192 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.599 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 20.4 mp0 -69.68 -40.71 76.22 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.296 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.955 HD22 HD22 ' A' ' 57' ' ' LEU . 8.2 tt -62.32 -51.4 67.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.434 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.479 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.85 -30.34 77.72 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.489 ' HZ1' ' HB3' ' A' ' 29' ' ' LEU . 0.0 OUTLIER -54.56 -49.86 69.32 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.768 0.318 . . . . 0.0 110.262 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 1.056 HG22 ' SD ' ' A' ' 47' ' ' MET . 1.3 t -72.94 -30.41 32.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.808 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.1 mmm -59.31 -45.08 92.27 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.609 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 73.4 mtp85 -67.25 -37.49 83.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' MET . . . . . 1.056 ' SD ' HG22 ' A' ' 44' ' ' VAL . 1.5 ptm -52.9 -30.23 33.02 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.499 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.617 HD13 ' HA ' ' A' ' 153' ' ' MET . 16.6 mt -93.31 -5.46 49.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.776 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 105.57 7.42 36.89 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.609 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 58.9 mm-40 -85.44 138.86 31.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.777 0.322 . . . . 0.0 111.038 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 30.1 t-20 -126.36 59.14 29.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.376 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.589 ' HG2' HD11 ' A' ' 57' ' ' LEU . 73.4 Cg_endo -80.19 142.04 14.94 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 C-N-CA 122.718 2.279 . . . . 0.0 112.864 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.566 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 63.6 p -81.16 160.5 65.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.376 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -56.86 -36.82 99.07 Favored 'Trans proline' 0 C--N 1.295 -2.271 0 C-N-CA 122.747 2.298 . . . . 0.0 111.761 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -62.18 -49.47 75.66 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.978 0.418 . . . . 0.0 110.763 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.574 ' OE2' ' HB2' ' A' ' 52' ' ' PRO . 1.3 pp20? -72.56 -34.99 67.88 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.955 HD22 HD22 ' A' ' 41' ' ' LEU . 38.2 mt -65.16 -41.7 94.43 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.584 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.466 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 29.0 tt0 -61.93 -42.22 98.84 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.18 -179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -62.55 -51.8 65.95 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.426 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.792 ' CE ' HD21 ' A' ' 41' ' ' LEU . 2.5 ppp? -58.49 -34.65 71.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.035 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.915 HD12 HG23 ' A' ' 38' ' ' THR . 15.5 mt -60.92 -44.57 98.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.082 0.468 . . . . 0.0 110.807 177.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.634 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 34.1 t70 -61.0 -27.43 68.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.854 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -49.4 -38.44 28.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.62 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -111.95 -3.78 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.732 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.634 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 51.4 t0 -79.65 104.78 10.48 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.195 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -63.62 -45.59 89.61 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.418 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.573 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 54.6 p30 -91.38 -0.19 57.61 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.839 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.539 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 60.42 29.75 69.92 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.608 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 3.0 p -69.79 -0.02 6.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.839 0.352 . . . . 0.0 110.763 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.564 ' N ' ' OD2' ' A' ' 65' ' ' ASP . . . 76.77 14.23 82.76 Favored Glycine 0 CA--C 1.521 0.409 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.65 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.0 p -139.74 132.51 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -101.64 110.0 27.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.002 179.173 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.451 ' CG ' ' OE1' ' A' ' 76' ' ' GLU . 55.2 p-10 -78.98 -169.05 1.65 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.227 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.881 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.1 t80 -55.64 -50.09 71.13 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.452 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.543 ' O ' HG23 ' A' ' 79' ' ' VAL . 98.2 m-20 -62.43 -42.77 99.7 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.118 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' A' ' 65' ' ' ASP . 25.7 mt-10 -64.81 -42.07 95.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.381 0.61 . . . . 0.0 110.354 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.683 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -69.62 -44.9 69.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.916 179.532 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.881 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -57.05 -37.21 71.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.757 ' O ' HG13 ' A' ' 82' ' ' VAL . 42.1 t -60.97 -43.25 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.207 178.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.428 ' HB2' HG11 ' A' ' 64' ' ' VAL . 1.6 ttm -54.48 -42.76 71.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.536 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 14.4 mmt -59.85 -45.45 92.39 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.49 . . . . 0.0 110.282 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 79' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.434 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.862 ' O ' HG23 ' A' ' 148' ' ' ILE . 11.1 tt . . . . . 0 N--CA 1.461 0.104 0 CA-C-O 120.635 0.255 . . . . 0.0 110.8 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.564 ' C ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -26.88 111.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.635 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.508 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.67 -39.49 88.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.483 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -44.69 -80.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.132 0.492 . . . . 0.0 110.457 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.81 -35.81 77.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.773 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.705 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 13.6 ttt -49.94 -51.84 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.885 0.374 . . . . 0.0 110.291 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.859 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 16.1 mtp -69.43 -32.04 70.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.472 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.554 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.6 mt-30 -59.9 -42.06 93.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.103 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.495 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.52 -42.88 98.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.388 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.758 HD22 HG21 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -66.65 -38.04 86.05 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.55 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.496 HD11 ' HG2' ' A' ' 19' ' ' GLU . 86.9 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.383 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.623 HD13 ' C ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.069 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.65 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.1 m-30 -68.65 -33.68 74.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.562 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -56.89 -46.86 81.63 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.583 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -62.55 -35.71 80.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -55.66 -40.95 72.96 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.251 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.786 HG22 HD12 ' A' ' 78' ' ' LEU . 68.8 t -63.14 -46.95 94.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.91 -23.3 61.45 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.543 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 84.2 mm-40 -70.43 -35.72 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.658 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.7 ' CD1' HD11 ' A' ' 78' ' ' LEU . 21.9 mt -57.76 126.09 25.85 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.641 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.876 HG23 ' H ' ' A' ' 16' ' ' GLN . 1.5 t -64.12 175.19 1.31 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.284 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.0 mm-40 -60.88 -43.06 98.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.59 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -71.55 -48.14 50.5 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.876 ' H ' HG23 ' A' ' 13' ' ' THR . 61.0 tt0 -61.18 -43.86 98.21 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.295 0.569 . . . . 0.0 110.393 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -68.26 -32.23 72.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.63 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.2 t-20 -60.87 -44.24 97.33 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.884 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -60.71 -44.37 96.68 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.129 0.49 . . . . 0.0 109.835 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.653 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 30.6 m-85 -66.76 -38.04 85.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.847 179.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -60.25 -40.11 89.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.074 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.915 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -59.79 -42.02 92.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.741 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.66 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -62.21 -40.29 95.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.582 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 16.8 t80 -57.64 -49.17 77.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.787 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 29' ' ' LEU . 36.1 t70 -63.49 -40.16 96.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.606 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.97 HD13 ' CB ' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -57.81 -44.02 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.584 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.779 ' CE1' HG11 ' A' ' 44' ' ' VAL . 17.4 m-85 -61.71 -43.12 99.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.738 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.666 HG21 ' O ' ' A' ' 34' ' ' GLY . 28.0 m -102.9 26.96 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.621 ' HB3' ' HZ1' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -57.49 105.67 0.26 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.376 -179.722 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 3.4 67.82 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.485 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -63.44 136.44 57.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.289 . . . . 0.0 110.368 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -61.81 -44.79 96.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.544 ' OD1' ' O ' ' A' ' 33' ' ' ASP . 64.6 t0 -92.43 -22.37 19.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.666 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 88.51 -8.04 80.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.547 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 59.5 p -81.15 137.52 35.93 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.631 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.657 HG12 HG13 ' A' ' 28' ' ' VAL . 96.6 mt -74.19 105.8 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.056 0.455 . . . . 0.0 110.974 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.682 ' CB ' HG22 ' A' ' 71' ' ' THR . 4.8 p -102.45 -172.49 2.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.693 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.608 ' O ' HD13 ' A' ' 57' ' ' LEU . 16.3 p -60.88 -37.18 81.27 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.437 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -69.93 -49.18 54.53 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.337 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.583 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 46.9 mp0 -64.35 -42.9 96.0 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.846 HD23 HD22 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -64.06 -48.54 75.83 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.89 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.2 -37.55 94.71 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.581 -1.008 . . . . 0.0 110.581 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.621 ' HZ1' ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -50.37 -63.45 1.12 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 109.851 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.904 HG22 ' HE2' ' A' ' 47' ' ' MET . 13.2 t -59.45 -36.29 63.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.662 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 77.8 mmm -55.35 -39.5 70.12 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.667 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 10.4 mtm105 -66.68 -32.85 74.42 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.904 ' HE2' HG22 ' A' ' 44' ' ' VAL . 32.6 mtm -59.18 -37.43 77.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.783 HD22 ' N ' ' A' ' 48' ' ' LEU . 2.3 mm? -83.76 -5.33 59.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.623 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.37 11.22 34.14 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.667 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -91.25 138.74 31.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.154 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.452 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 34.6 p30 -127.24 57.75 25.75 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.892 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.514 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 68.9 Cg_endo -78.47 150.4 25.02 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.711 2.274 . . . . 0.0 112.56 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.7 p -89.96 156.51 46.78 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.597 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.504 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 52.3 Cg_exo -55.6 -40.26 86.35 Favored 'Trans proline' 0 C--N 1.301 -1.935 0 C-N-CA 122.762 2.308 . . . . 0.0 111.909 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -61.3 -49.65 76.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.497 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.458 ' O ' ' SD ' ' A' ' 60' ' ' MET . 78.7 mm-40 -69.37 -38.99 78.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.18 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.846 HD22 HD23 ' A' ' 41' ' ' LEU . 26.3 mt -60.25 -28.43 68.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.698 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -58.87 -40.02 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.126 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -63.49 -47.85 80.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.631 0.729 . . . . 0.0 110.779 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.547 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.17 -38.9 90.85 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.914 179.698 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.777 HG21 ' O ' ' A' ' 70' ' ' GLY . 17.3 mm -62.36 -45.56 98.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.362 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.638 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.0 t70 -64.26 -23.14 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.807 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -53.66 -41.08 66.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.572 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.526 HG11 ' HB3' ' A' ' 80' ' ' MET . 0.9 OUTLIER -114.68 -3.52 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.4 . . . . 0.0 110.718 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.638 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 63.5 t0 -88.16 88.67 7.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -71.88 -26.74 62.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.924 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.56 -11.46 60.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.967 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.04 21.73 64.06 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.019 -0.833 . . . . 0.0 111.019 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 p -85.93 0.7 52.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.887 0.375 . . . . 0.0 110.747 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.777 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 72.69 15.51 77.84 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.682 HG22 ' CB ' ' A' ' 37' ' ' SER . 9.8 p -139.43 126.9 21.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.903 0.382 . . . . 0.0 110.657 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.691 HG22 ' O ' ' A' ' 72' ' ' VAL . 0.2 OUTLIER -91.37 107.72 19.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.348 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.463 ' OD1' ' CG ' ' A' ' 76' ' ' GLU . 52.3 p-10 -74.34 -169.08 0.75 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.508 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 1.027 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.8 t80 -57.41 -50.69 72.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 -179.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -62.93 -41.92 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.816 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.614 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 30.8 mt-10 -64.87 -43.26 93.52 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.189 0.519 . . . . 0.0 110.381 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.707 ' HA ' ' HE3' ' A' ' 80' ' ' MET . 0.0 OUTLIER -68.88 -39.76 79.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.443 0.639 . . . . 0.0 109.724 179.739 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.027 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -60.38 -37.03 79.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.431 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.621 ' O ' HG13 ' A' ' 82' ' ' VAL . 28.3 t -61.88 -42.28 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.967 178.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.707 ' HE3' ' HA ' ' A' ' 77' ' ' PHE . 2.6 ptp -56.48 -38.54 71.87 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.878 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.425 ' N ' ' CG ' ' A' ' 80' ' ' MET . 21.1 mmt -62.42 -47.76 82.67 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.65 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.502 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.292 179.179 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.464 HG23 ' O ' ' A' ' 148' ' ' ILE . 5.4 tp . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.747 0.308 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.61 ' O ' ' CB ' ' A' ' 153' ' ' MET . 29.6 m -71.87 88.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.986 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.585 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.62 -31.95 69.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.834 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -53.02 -48.69 67.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.038 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.405 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -107.56 -18.98 13.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.954 0.407 . . . . 0.0 111.064 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.726 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -57.12 -45.98 83.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.226 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.66 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 mtp -70.01 -29.82 66.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.577 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.405 ' OE1' ' HA ' ' A' ' 152' ' ' ALA . 82.3 mt-30 -62.05 -39.61 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.449 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' A' ' 48' ' ' LEU . . . -62.27 -25.27 67.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.781 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.97 ' CB ' HD13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -97.13 -51.97 4.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.756 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 22' ' ' ALA . 94.6 mt . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.543 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.718 ' C ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.637 ' HA ' HG21 ' A' ' 82' ' ' VAL . 20.9 m-30 -69.2 -31.89 70.8 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.551 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.76 -45.37 89.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.05 -34.15 76.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.511 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -58.39 -42.01 86.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.758 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.838 HG22 HD12 ' A' ' 78' ' ' LEU . 95.4 t -63.71 -43.95 98.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -68.58 -24.3 64.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.522 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -71.15 -35.4 71.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.691 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.832 HD13 ' CD1' ' A' ' 20' ' ' PHE . 17.2 mt -64.5 107.8 1.48 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.277 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.706 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -51.21 -179.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.649 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.553 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 76.5 mm-40 -60.92 -44.77 96.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.981 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -70.92 -45.7 63.8 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.95 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.706 ' H ' HG23 ' A' ' 13' ' ' THR . 6.6 tt0 -63.66 -44.34 94.08 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.178 0.514 . . . . 0.0 110.127 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.586 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.6 ttmt -70.44 -30.83 67.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.589 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.553 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 63.0 t30 -60.33 -44.46 95.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.106 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.41 -45.44 93.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.106 0.479 . . . . 0.0 109.947 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.832 ' CD1' HD13 ' A' ' 12' ' ' LEU . 28.4 m-85 -65.11 -39.01 92.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.198 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -60.53 -39.51 88.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.836 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.895 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.53 -42.22 96.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.852 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.753 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.66 -39.41 91.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.181 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.707 ' O ' HG22 ' A' ' 28' ' ' VAL . 17.2 t80 -57.27 -48.63 78.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.638 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.587 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.75 -39.55 94.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.527 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.895 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -56.65 -45.88 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.528 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.709 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 22.6 m-85 -62.03 -41.99 98.69 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.365 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.707 HG22 ' O ' ' A' ' 24' ' ' PHE . 15.7 m -101.57 21.36 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.427 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -53.12 112.47 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.325 -179.825 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.32 -9.07 78.35 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.595 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -63.15 127.03 29.38 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.247 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.11 -41.39 97.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.56 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.5 p30 -81.36 -22.38 38.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.874 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.56 ' N ' ' OD1' ' A' ' 33' ' ' ASP . . . 78.73 -2.5 68.01 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.58 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 57.6 p -90.6 136.93 32.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.878 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -73.6 106.22 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.662 -0.415 . . . . 0.0 111.358 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.585 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 56.1 p -101.94 161.65 13.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.798 179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.86 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -41.66 -35.58 0.79 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.611 -179.339 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -49.54 57.31 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.585 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 3.4 mp0 -67.18 -40.06 86.51 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.877 ' CD2' HD22 ' A' ' 57' ' ' LEU . 6.6 tt -60.06 -50.44 73.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.44 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.458 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.93 -35.74 92.26 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.5 -60.98 2.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.22 0.534 . . . . 0.0 109.947 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.85 HG22 ' HE2' ' A' ' 47' ' ' MET . 25.5 t -61.06 -38.93 80.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 177.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.636 ' HB3' ' HB2' ' A' ' 50' ' ' GLN . 88.8 mmm -54.46 -41.6 69.67 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 71.6 mtp180 -65.01 -32.65 74.49 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.85 ' HE2' HG22 ' A' ' 44' ' ' VAL . 33.1 mtm -58.7 -37.3 75.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.828 ' N ' HD22 ' A' ' 48' ' ' LEU . 2.1 mm? -85.76 0.01 54.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.516 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.36 5.45 57.01 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.645 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 5.8 mm-40 -80.53 138.49 36.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.961 0.41 . . . . 0.0 110.955 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.463 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 26.6 p-10 -128.54 56.79 24.28 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.309 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.7 ' CG ' HD21 ' A' ' 57' ' ' LEU . 64.0 Cg_endo -77.67 139.86 18.27 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.721 2.281 . . . . 0.0 112.864 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.6 p -78.6 158.16 76.29 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.47 -35.21 84.57 Favored 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.726 2.284 . . . . 0.0 111.824 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -61.02 -51.6 68.53 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.21 0.529 . . . . 0.0 110.387 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.579 ' O ' ' CE ' ' A' ' 60' ' ' MET . 72.9 mt-10 -69.64 -39.89 76.84 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.327 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.877 HD22 ' CD2' ' A' ' 41' ' ' LEU . 43.4 mt -61.48 -37.75 84.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.678 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.527 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 50.6 tt0 -59.8 -41.36 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.733 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -62.85 -41.86 99.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.255 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.579 ' CE ' ' O ' ' A' ' 56' ' ' GLU . 4.4 mmt -62.57 -39.09 92.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.86 HD11 ' N ' ' A' ' 38' ' ' THR . 2.8 mt -61.65 -45.7 98.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.489 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 14.9 t70 -60.14 -36.08 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.565 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -45.98 -38.91 8.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.157 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.483 HG11 ' HB3' ' A' ' 80' ' ' MET . 0.6 OUTLIER -113.88 -10.11 12.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.555 ' OD1' ' OG ' ' A' ' 69' ' ' SER . 16.0 t70 -96.65 67.37 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.323 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -67.71 -17.62 64.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.793 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.466 ' OD1' ' OD2' ' A' ' 65' ' ' ASP . 49.6 p-10 -75.93 -10.3 59.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.496 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.68 14.45 75.26 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.555 ' OG ' ' OD1' ' A' ' 65' ' ' ASP . 88.1 p -71.86 -16.84 62.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.617 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.46 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 72.97 17.04 78.34 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.583 ' CG2' ' HB3' ' A' ' 37' ' ' SER . 0.2 OUTLIER -149.2 119.43 7.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.924 0.392 . . . . 0.0 110.76 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.878 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.1 OUTLIER -85.99 110.38 19.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.44 179.846 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.543 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -81.49 -162.29 0.5 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.886 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.9 t80 -56.72 -49.52 74.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.775 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.468 ' O ' HG23 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -65.6 -44.96 85.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.644 179.526 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.62 ' C ' HG23 ' A' ' 72' ' ' VAL . 53.2 mt-10 -62.69 -41.37 99.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.321 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.759 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -71.04 -44.34 66.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.186 0.517 . . . . 0.0 109.634 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.886 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.1 -37.33 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.619 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.539 ' HA ' ' CG1' ' A' ' 82' ' ' VAL . 42.6 t -63.84 -41.73 93.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.037 178.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.735 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -54.25 -38.34 65.68 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.204 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.735 ' N ' ' HG2' ' A' ' 80' ' ' MET . 12.7 mmt -65.36 -48.25 73.61 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 121.255 0.55 . . . . 0.0 110.848 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.637 HG21 ' HA ' ' A' ' 5' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.613 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.546 ' O ' HG23 ' A' ' 148' ' ' ILE . 12.6 tt . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.743 0.306 . . . . 0.0 110.485 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.576 ' O ' ' CB ' ' A' ' 153' ' ' MET . 3.4 m -70.19 103.73 2.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.387 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.499 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.85 -38.81 83.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.341 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.613 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -45.02 -82.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.435 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -60.41 -35.2 75.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.805 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.601 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 9.5 ttt -49.74 -52.41 31.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.245 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.753 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.7 mtp -71.1 -29.21 64.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.481 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 52.7 mt-30 -60.3 -44.09 95.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.345 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.81 98.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.077 0.465 . . . . 0.0 110.17 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -64.37 -42.13 96.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.642 -179.533 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.405 -179.826 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.61 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.283 0 CA-C-O 121.025 0.44 . . . . 0.0 109.982 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.668 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.2 m-30 -69.95 -34.0 72.85 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.604 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -54.9 -45.61 74.74 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.302 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 11' ' ' GLN . . . -65.1 -33.27 75.63 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.601 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.84 -40.27 83.75 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.877 HG22 HD12 ' A' ' 78' ' ' LEU . 95.1 t -61.98 -46.13 97.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.046 0.45 . . . . 0.0 109.788 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -73.42 -23.78 60.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 7' ' ' ALA . 3.1 mm-40 -72.03 -38.6 69.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.779 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.76 HD12 HD11 ' A' ' 78' ' ' LEU . 21.5 mt -49.4 118.72 2.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.734 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.657 HG22 ' HB2' ' A' ' 16' ' ' GLN . 8.8 t -56.33 -177.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.374 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.548 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 88.0 tt0 -60.04 -44.01 94.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.434 ' H ' HG23 ' A' ' 13' ' ' THR . 86.5 tt0 -74.0 -51.23 16.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.657 ' HB2' HG22 ' A' ' 13' ' ' THR . 13.0 mt-30 -50.47 -52.76 35.23 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.591 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.0 ttmt -66.18 -35.06 79.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.046 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.548 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 62.2 t30 -59.6 -43.77 93.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.199 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.48 ' O ' ' HE3' ' A' ' 154' ' ' MET . 12.6 mt-10 -61.02 -46.92 88.78 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.196 0.522 . . . . 0.0 110.492 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.64 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 67.4 m-85 -66.15 -38.54 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.224 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -56.5 -42.58 78.57 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.993 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.77 -40.86 94.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.915 178.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.866 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.185 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.675 ' O ' HG22 ' A' ' 28' ' ' VAL . 15.9 t80 -57.32 -48.23 79.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.444 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.609 ' O ' ' N ' ' A' ' 29' ' ' LEU . 64.6 t0 -62.23 -40.02 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.393 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.993 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.33 -46.35 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.75 179.674 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.791 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 12.9 m-85 -60.66 -41.32 94.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.459 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.801 HG13 HG12 ' A' ' 36' ' ' ILE . 25.1 m -107.22 25.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.619 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.656 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -56.97 105.93 0.26 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.305 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.49 -9.32 58.94 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.595 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -64.14 129.76 41.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.806 0.336 . . . . 0.0 110.517 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.63 -43.85 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.779 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 50.2 p30 -80.09 -23.36 41.33 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.834 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.6 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 79.68 1.81 87.32 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.649 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 75.4 p -90.98 135.67 33.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.625 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.832 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -77.6 110.46 13.31 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.101 -179.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.587 ' C ' HD11 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -108.86 -178.58 3.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.05 178.918 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.611 ' N ' HD11 ' A' ' 61' ' ' ILE . 2.8 p -58.58 -24.23 60.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.516 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -84.46 -48.37 9.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.229 178.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.677 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 60.3 mp0 -71.96 -20.81 61.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.581 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.975 HD22 HD22 ' A' ' 57' ' ' LEU . 10.0 tt -83.2 -49.28 9.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.951 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.553 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -60.15 -38.08 93.87 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.677 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.41 -58.22 4.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.731 0.3 . . . . 0.0 110.305 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.834 ' CG2' HG22 ' A' ' 26' ' ' ILE . 3.0 t -62.85 -32.09 54.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.595 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 89.6 mmm -60.19 -42.61 95.43 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.716 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 40.1 mtp180 -67.45 -32.04 72.63 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.637 ' HE2' HG22 ' A' ' 44' ' ' VAL . 26.8 mtm -59.53 -36.65 76.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.881 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.581 HD21 ' HB3' ' A' ' 156' ' ' ALA . 73.4 mt -88.59 -0.79 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.314 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.6 4.15 52.54 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.716 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 25.2 mm100 -90.34 135.27 33.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.972 0.415 . . . . 0.0 110.574 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.557 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 34.1 t-20 -134.11 60.99 48.29 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.892 ' HG2' HD21 ' A' ' 57' ' ' LEU . 60.2 Cg_endo -75.46 149.14 34.48 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.684 2.256 . . . . 0.0 112.41 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.623 ' OG1' ' OE1' ' A' ' 56' ' ' GLU . 62.6 p -81.64 161.68 60.65 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.056 0.455 . . . . 0.0 110.623 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 47.1 Cg_exo -54.63 -39.36 89.14 Favored 'Trans proline' 0 C--N 1.303 -1.821 0 C-N-CA 122.71 2.273 . . . . 0.0 111.837 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -62.77 -50.49 70.85 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.154 0.502 . . . . 0.0 110.827 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.623 ' OE1' ' OG1' ' A' ' 53' ' ' THR . 21.9 mp0 -67.94 -39.68 83.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.841 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.975 HD22 HD22 ' A' ' 41' ' ' LEU . 23.0 mt -62.09 -39.37 92.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.754 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -59.43 -40.66 87.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.34 -49.33 76.01 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.026 0.441 . . . . 0.0 111.203 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.814 ' SD ' HD23 ' A' ' 57' ' ' LEU . 2.3 ptp -64.74 -35.16 80.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.489 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.72 HG12 HD13 ' A' ' 41' ' ' LEU . 1.1 mt -62.63 -46.61 95.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.075 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 13.2 t70 -61.45 -30.22 70.44 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -47.1 -37.14 9.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.283 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 1.5 m -114.52 -16.3 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.662 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.564 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 38.8 t70 -88.25 78.31 8.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.47 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -72.77 -11.65 60.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.782 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.53 -12.13 60.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.532 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.29 14.07 68.38 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 85.7 p -85.1 -6.41 59.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 110.713 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.535 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 71.51 17.88 76.66 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.649 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 0.9 OUTLIER -138.45 124.12 19.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.934 0.397 . . . . 0.0 110.76 -179.636 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.832 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -90.12 117.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.421 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.51 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 45.3 p-10 -82.26 -168.12 1.85 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.609 179.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.98 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -56.84 -51.06 70.48 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.714 -179.521 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.67 -42.59 95.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.899 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.604 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 46.4 mt-10 -64.49 -42.05 96.09 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.109 0.48 . . . . 0.0 110.575 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.731 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -70.29 -43.19 70.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.797 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.98 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.92 -37.79 61.15 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.575 ' O ' HG13 ' A' ' 82' ' ' VAL . 39.7 t -61.56 -45.87 97.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.162 0.506 . . . . 0.0 110.42 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.714 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -53.6 -36.88 62.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.305 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.714 ' N ' ' HG2' ' A' ' 80' ' ' MET . 24.7 mmt -66.55 -50.0 64.6 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.198 0.523 . . . . 0.0 110.494 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.668 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.62 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.306 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.574 HD12 ' SD ' ' A' ' 45' ' ' MET . 18.7 tt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.727 0.299 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' SER . . . . . 0.65 ' O ' ' CB ' ' A' ' 153' ' ' MET . 68.4 m -67.37 92.91 0.3 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.254 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -50.04 -34.09 20.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.514 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.534 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -62.17 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.229 0.537 . . . . 0.0 110.891 179.563 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -60.46 -30.92 69.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.554 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 153' ' ' MET . . . . . 0.791 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 ttt -50.96 -54.5 23.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.652 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' MET . . . . . 0.866 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.9 mtp -65.77 -31.84 73.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.193 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.3 mt-30 -60.69 -41.47 95.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.882 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ALA . . . . . 0.581 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.57 -39.89 95.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.095 0.474 . . . . 0.0 110.267 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.688 HD22 HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -71.6 -48.08 50.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.27 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' A' ' 22' ' ' ALA . 91.9 mt . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.777 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.697 ' CE ' HG21 ' A' ' 79' ' ' VAL . 2.1 tpt . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.45 129.1 39.55 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.287 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 68.8 m-20 -70.08 -38.65 75.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.701 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.577 ' C ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -58.09 -44.03 86.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.405 -0.518 . . . . 0.0 109.796 -179.656 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.644 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.0 m-30 -72.9 -29.33 63.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.606 178.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -59.02 -46.49 88.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.579 -0.896 . . . . 0.0 108.579 179.305 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.92 81.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.455 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.67 -40.88 80.39 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.6 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.035 HG22 HD12 ' A' ' 78' ' ' LEU . 75.4 t -62.48 -47.3 93.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.626 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.64 -24.76 66.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.648 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -70.47 -36.32 73.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.045 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 78' ' ' LEU . 57.6 mt -58.53 127.9 34.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.266 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 1.025 HG23 ' H ' ' A' ' 16' ' ' GLN . 4.4 t -61.87 171.37 1.68 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -60.69 -39.98 90.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.17 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -48.81 45.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 1.025 ' H ' HG23 ' A' ' 13' ' ' THR . 64.5 tt0 -62.61 -42.73 99.75 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.132 0.492 . . . . 0.0 110.585 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 32.3 ttmt -66.81 -35.24 79.61 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.689 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -59.34 -44.07 92.69 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.488 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -61.84 -44.78 96.14 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.402 0.62 . . . . 0.0 109.957 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.673 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 14.1 m-30 -64.45 -38.66 91.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.766 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 24' ' ' PHE . 24.7 tptm -59.09 -39.76 83.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.88 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.798 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -59.65 -42.62 93.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.845 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.54 -38.53 87.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.01 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.639 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 17.3 t80 -56.57 -49.56 74.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.607 ' O ' ' N ' ' A' ' 29' ' ' LEU . 61.6 t0 -62.27 -39.23 92.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.263 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.798 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.5 OUTLIER -56.4 -44.48 80.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.669 179.896 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.652 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 16.8 m-85 -62.17 -42.71 99.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.375 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.687 HG13 ' CG1' ' A' ' 36' ' ' ILE . 6.2 m -97.51 11.37 5.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.741 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.607 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -42.03 108.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.06 12.74 58.57 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.651 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -83.9 128.76 34.77 Favored 'General case' 0 C--N 1.331 -0.239 0 O-C-N 122.777 -0.249 . . . . 0.0 110.555 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -64.18 -40.73 96.72 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.701 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -21.96 25.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.565 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 81.35 -1.23 86.11 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.591 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 55.6 p -86.16 135.46 33.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.687 ' CG1' HG13 ' A' ' 28' ' ' VAL . 89.6 mt -76.87 105.65 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.106 0.479 . . . . 0.0 110.709 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.864 ' HB3' HG22 ' A' ' 71' ' ' THR . 60.3 p -103.33 177.49 4.83 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.701 HG22 ' C ' ' A' ' 57' ' ' LEU . 6.9 p -53.32 -39.59 64.15 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.043 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -66.47 -44.44 82.71 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.634 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 71.1 mm-40 -73.53 -20.69 60.58 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 109.956 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.609 ' O ' ' HG2' ' A' ' 45' ' ' MET . 0.4 OUTLIER -81.82 -47.37 12.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.54 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.504 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -60.94 -37.94 94.63 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.369 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.634 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -48.69 -57.29 6.51 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.203 0.502 . . . . 0.0 110.276 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.757 HG21 HG22 ' A' ' 26' ' ' ILE . 11.8 t -63.67 -35.63 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 CA-C-O 121.097 0.475 . . . . 0.0 110.019 177.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.609 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 87.5 mmm -59.06 -41.58 88.26 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.636 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 76.5 mtp85 -66.42 -33.16 75.08 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.556 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 20.5 mtm -59.75 -38.28 81.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.969 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.624 HD11 ' HG3' ' A' ' 153' ' ' MET . 79.3 mt -84.19 -1.87 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.857 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.41 8.77 52.25 Favored Glycine 0 CA--C 1.529 0.906 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.636 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 87.0 mm-40 -90.83 138.08 31.86 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.855 0.36 . . . . 0.0 111.078 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.599 ' ND2' ' O ' ' A' ' 51' ' ' ASN . 0.7 OUTLIER -127.38 60.89 46.1 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.81 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.652 ' HG2' HD11 ' A' ' 57' ' ' LEU . 81.7 Cg_endo -79.32 139.89 15.02 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.573 2.182 . . . . 0.0 112.169 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 73.8 p -74.25 152.31 88.09 Favored Pre-proline 0 CA--C 1.516 -0.34 0 CA-C-O 121.037 0.446 . . . . 0.0 110.323 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.13 -43.06 60.0 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 122.722 2.281 . . . . 0.0 112.294 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -62.74 -40.28 96.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.168 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.434 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 0.9 OUTLIER -78.84 -31.89 45.88 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.701 ' C ' HG22 ' A' ' 38' ' ' THR . 3.1 mt -60.96 -26.27 67.42 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.16 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.56 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 37.7 tt0 -58.93 -37.74 77.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.723 -178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -61.58 -41.28 97.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.158 0.504 . . . . 0.0 110.804 178.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.492 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 3.6 mmt -64.51 -42.02 96.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.763 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.562 HG21 ' O ' ' A' ' 70' ' ' GLY . 10.2 mm -61.62 -44.56 98.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.696 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.507 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 66.0 t0 -59.79 -29.91 68.53 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.33 -42.88 10.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.972 0.415 . . . . 0.0 110.338 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.472 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 0.3 OUTLIER -113.2 -12.34 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.267 179.677 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.513 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 30.7 t70 -91.98 63.24 4.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.399 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.598 ' OE1' ' N ' ' A' ' 1' ' ' MET . 85.2 tt0 -65.21 -21.0 66.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.821 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.413 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 58.7 p-10 -74.67 -8.48 56.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.896 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.74 15.17 75.69 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.4 m -66.21 -26.74 67.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.927 0.394 . . . . 0.0 110.405 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.562 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 86.41 -1.14 87.34 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.864 HG22 ' HB3' ' A' ' 37' ' ' SER . 25.6 p -136.44 133.77 36.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.922 0.391 . . . . 0.0 110.926 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.732 HG22 ' O ' ' A' ' 72' ' ' VAL . 0.2 OUTLIER -100.48 103.82 15.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.217 0.532 . . . . 0.0 109.972 179.212 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.538 ' OD1' ' HA ' ' A' ' 35' ' ' SER . 18.1 m-20 -72.27 -163.9 0.13 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.302 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 1.02 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.4 t80 -57.86 -49.88 75.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.004 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.464 ' O ' HG23 ' A' ' 79' ' ' VAL . 97.3 m-20 -62.99 -42.29 99.8 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.017 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.534 ' CD ' ' HA ' ' A' ' 72' ' ' VAL . 45.5 mt-10 -64.38 -42.09 96.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.385 0.612 . . . . 0.0 111.132 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.713 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -71.33 -41.13 70.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.999 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.035 HD12 HG22 ' A' ' 9' ' ' VAL . 0.3 OUTLIER -58.39 -37.22 74.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.846 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.697 HG21 ' CE ' ' A' ' 1' ' ' MET . 42.1 t -60.69 -42.53 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 N-CA-C 109.335 -0.616 . . . . 0.0 109.335 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.508 ' HA ' ' HD3' ' A' ' 83' ' ' ARG . 1.0 OUTLIER -53.27 -43.53 67.5 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.916 -0.714 . . . . 0.0 110.083 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.654 ' O ' ' SD ' ' A' ' 85' ' ' MET . 24.7 mmt -60.83 -45.27 95.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.762 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.734 ' HA ' ' HB2' ' A' ' 85' ' ' MET . 0.2 OUTLIER -74.79 -27.33 20.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.672 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.614 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 76.7 mtp85 -60.57 -42.56 96.92 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.609 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 55.5 m -92.85 -15.27 26.66 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.532 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.734 ' HB2' ' HA ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -70.79 -48.14 55.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.208 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -94.16 -8.16 40.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.608 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.568 ' CB ' ' O ' ' A' ' 83' ' ' ARG . 66.3 t0 -93.46 97.09 10.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.308 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.607 ' OD1' ' N ' ' A' ' 89' ' ' SER . 5.0 p30 -68.44 -38.76 81.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.567 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.607 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 22.0 t 179.06 71.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.563 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -144.33 134.35 24.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.526 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -150.65 163.82 29.72 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.626 ' O ' ' CD1' ' A' ' 138' ' ' PHE . 5.7 ptmm? -61.3 -23.77 65.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.817 0.342 . . . . 0.0 110.608 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.626 ' CD1' ' O ' ' A' ' 137' ' ' LYS . 1.1 m-85 178.57 -87.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.578 ' O ' ' O ' ' A' ' 140' ' ' ARG . 10.8 mmmm 49.86 30.44 3.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.61 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.578 ' O ' ' O ' ' A' ' 139' ' ' LYS . 8.6 ptp180 44.14 177.44 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.298 0.57 . . . . 0.0 110.951 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.608 ' O ' ' CB ' ' A' ' 142' ' ' THR . 6.3 Cg_exo -73.18 171.82 16.83 Favored 'Trans proline' 0 C--N 1.302 -1.901 0 C-N-CA 123.831 3.021 . . . . 0.0 111.48 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.608 ' CB ' ' O ' ' A' ' 141' ' ' PRO . 0.7 OUTLIER 92.31 112.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.093 0.473 . . . . 0.0 111.017 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.608 ' O ' ' N ' ' A' ' 145' ' ' ARG . 24.5 mt 36.26 63.21 0.64 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.447 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -54.91 76.82 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.956 0.408 . . . . 0.0 110.7 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.608 ' N ' ' O ' ' A' ' 143' ' ' LEU . 37.9 ttm-85 -176.49 -50.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.496 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' VAL . . . . . 0.578 ' C ' ' O ' ' A' ' 145' ' ' ARG . 0.0 OUTLIER 18.37 52.99 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.719 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER -103.85 142.78 33.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.646 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.732 ' O ' HG23 ' A' ' 148' ' ' ILE . 20.8 tt -39.68 111.61 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.921 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.635 ' O ' ' CB ' ' A' ' 153' ' ' MET . 66.3 m -42.21 96.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 148' ' ' ILE . . . -60.1 -39.1 84.99 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.326 0.391 . . . . 0.0 111.225 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.555 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 40.9 m-20 -50.88 -77.53 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.508 0.67 . . . . 0.0 110.811 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.6 -35.92 81.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.199 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.652 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 9.6 ttt -48.49 -53.78 16.73 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.382 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.845 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 2.0 mtp -65.93 -34.0 77.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.09 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.555 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 75.7 mt-30 -59.28 -43.28 92.53 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.62 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ALA . . . . . 0.441 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.32 -43.97 96.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -63.66 -41.02 98.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.482 -179.156 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.566 HD21 ' HB3' ' A' ' 22' ' ' ALA . 92.4 mt -88.24 -5.99 58.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.545 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 62.37 36.36 92.99 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 75.79 76.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 110.546 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.714 ' O ' ' HB2' ' A' ' 162' ' ' ALA . 75.7 ttt180 -104.31 90.4 3.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.577 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.714 ' HB2' ' O ' ' A' ' 161' ' ' ARG . . . 149.86 57.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.494 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 16.0 mttp 61.22 -157.53 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.69 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.4 -149.75 44.23 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -41.52 155.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.753 0.311 . . . . 0.0 110.176 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.431 ' O ' ' CG ' ' A' ' 167' ' ' HIS . 71.8 m80 -60.8 -38.2 84.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.088 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' HIS . . . . . 0.462 ' HA ' ' HB3' ' A' ' 160' ' ' ALA . 0.0 OUTLIER 171.52 -94.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.389 179.6 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 31.5 p80 -158.71 163.18 37.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.513 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' HIS . . . . . 0.552 ' ND1' ' O ' ' A' ' 170' ' ' HIS . 59.6 t-80 -133.49 129.04 36.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.583 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 170' ' ' HIS . . . . . 0.552 ' O ' ' ND1' ' A' ' 169' ' ' HIS . 96.4 m-70 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.596 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.5 ' C7 ' HD11 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.547 ' CE ' HG21 ' A' ' 79' ' ' VAL . 28.8 mtp . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -66.99 108.65 2.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.092 0.473 . . . . 0.0 110.533 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.525 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 70.3 m-20 -61.54 -40.15 93.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.166 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.629 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -55.07 -48.28 76.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.293 0.568 . . . . 0.0 109.855 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.656 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 21.6 m-30 -71.01 -29.05 64.89 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.616 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 1.4 mmpt? -58.93 -43.79 91.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.551 0.691 . . . . 0.0 109.282 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.63 -34.17 77.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.157 177.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.95 -41.41 82.77 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.611 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.675 HG13 ' HG ' ' A' ' 78' ' ' LEU . 72.2 t -62.24 -45.76 98.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.119 0.485 . . . . 0.0 109.705 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -70.06 -23.07 63.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.642 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.44 -33.74 67.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.536 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.587 HD12 HD11 ' A' ' 78' ' ' LEU . 13.9 mt -62.46 129.42 40.56 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.334 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.761 HG23 ' H ' ' A' ' 16' ' ' GLN . 2.6 t -69.64 -179.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.193 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 79.0 mm-40 -60.85 -45.03 96.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.138 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.85 -49.63 56.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.952 0.406 . . . . 0.0 111.454 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.761 ' H ' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -57.43 -51.31 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.273 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.65 -35.28 79.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.883 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.552 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.9 t-20 -60.04 -43.36 95.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.111 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.497 ' O ' ' CE ' ' A' ' 154' ' ' MET . 17.0 mt-10 -60.0 -51.06 71.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.353 179.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.667 ' CD2' ' SD ' ' A' ' 154' ' ' MET . 42.2 m-85 -62.69 -36.2 82.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.751 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.62 -41.3 85.6 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.767 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.67 -42.29 96.78 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.845 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.702 ' HB1' HD12 ' A' ' 157' ' ' LEU . . . -61.76 -39.14 90.58 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.041 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.762 ' O ' HG22 ' A' ' 28' ' ' VAL . 10.0 t80 -55.9 -49.75 72.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.391 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.419 ' O ' ' N ' ' A' ' 29' ' ' LEU . 38.7 t70 -62.45 -41.42 98.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.603 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.767 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -59.96 -42.45 89.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.291 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 1.102 ' CE1' HD11 ' A' ' 157' ' ' LEU . 5.6 m-85 -61.08 -39.42 89.85 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.33 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.762 HG22 ' O ' ' A' ' 24' ' ' PHE . 6.8 m -105.18 24.6 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.597 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -54.72 105.85 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.151 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.03 3.16 59.13 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.549 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -69.37 134.48 49.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 110.46 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -67.84 -42.03 82.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.526 ' O ' ' OD1' ' A' ' 33' ' ' ASP . 67.5 t0 -92.13 -20.83 20.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.389 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.703 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 88.48 -8.3 79.34 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.586 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.8 p -78.13 137.08 38.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.359 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.764 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.9 mt -75.82 107.86 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.893 0.378 . . . . 0.0 111.189 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.616 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 24.3 p -101.28 175.19 5.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.828 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.708 ' N ' HD11 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -55.66 -35.79 66.35 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.363 -179.393 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -71.86 -46.28 58.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.244 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.652 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . 33.1 mp0 -72.42 -20.93 61.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.826 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 45' ' ' MET . 1.1 tt -82.49 -48.97 10.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.932 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.541 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.57 -37.4 94.67 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.652 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.17 -57.53 4.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.376 -0.485 . . . . 0.0 110.121 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.718 HG11 ' CE1' ' A' ' 27' ' ' PHE . 11.3 t -62.68 -34.35 64.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.051 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . 1.007 ' SD ' HD12 ' A' ' 148' ' ' ILE . 91.3 mmm -58.59 -42.34 87.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 34.9 mtp-105 -66.57 -33.28 75.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 109.776 177.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.492 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 16.4 mtm -59.74 -37.08 77.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.865 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.819 HD21 ' HB3' ' A' ' 156' ' ' ALA . 69.7 mt -87.06 0.05 55.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.63 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.75 7.69 52.93 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.179 -0.769 . . . . 0.0 111.179 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.666 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 23.1 mm100 -96.06 131.94 41.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 110.831 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.464 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 40.2 t-20 -127.87 60.6 46.64 Favored Pre-proline 0 C--N 1.324 -0.542 0 C-N-CA 120.109 -0.636 . . . . 0.0 110.943 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.761 ' HG2' HD21 ' A' ' 57' ' ' LEU . 59.7 Cg_endo -76.72 138.35 18.93 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 C-N-CA 122.615 2.21 . . . . 0.0 112.355 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.1 p -72.06 154.06 92.5 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.0 110.502 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.98 -35.65 90.43 Favored 'Trans proline' 0 C--N 1.3 -1.996 0 C-N-CA 122.836 2.357 . . . . 0.0 111.705 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.88 -41.18 97.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.329 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.417 ' HB3' ' HE1' ' A' ' 60' ' ' MET . 2.8 mt-10 -81.26 -37.25 28.81 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.086 0.469 . . . . 0.0 110.418 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.761 HD21 ' HG2' ' A' ' 52' ' ' PRO . 52.4 mt -61.86 -31.24 71.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.525 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.529 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 46.5 tt0 -59.43 -42.33 91.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.989 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -67.0 -43.12 83.74 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.266 0.555 . . . . 0.0 110.557 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.528 ' HG2' ' S1 ' ' A' ' 201' ' ' V8Y . 3.4 mpp? -60.29 -38.52 83.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.34 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.708 HD11 ' N ' ' A' ' 38' ' ' THR . 1.1 mt -61.93 -46.83 95.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.024 0.44 . . . . 0.0 110.389 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.557 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 60.2 t0 -56.45 -26.7 54.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.396 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.544 ' O ' ' NH1' ' A' ' 83' ' ' ARG . 8.9 tp10 -45.77 -37.65 6.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.068 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.866 HG21 ' SD ' ' A' ' 80' ' ' MET . 0.2 OUTLIER -119.96 -13.77 8.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.741 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.544 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 29.2 t70 -86.39 68.12 10.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.521 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.516 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 86.7 tt0 -68.02 -17.17 64.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.67 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -12.66 60.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.62 -178.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.89 2.51 82.09 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.3 p -65.7 -18.24 65.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.838 0.351 . . . . 0.0 110.748 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.523 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 75.0 13.37 82.73 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.586 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.5 p -138.94 130.86 27.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.03 0.443 . . . . 0.0 110.802 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.764 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -96.45 112.8 29.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.917 179.483 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 14.0 p-10 -82.11 -165.83 1.1 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.371 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 1.017 ' HE1' HD23 ' A' ' 78' ' ' LEU . 2.1 t80 -57.08 -49.75 74.89 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.711 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -64.51 -44.22 91.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.778 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.497 ' OE1' ' HA ' ' A' ' 65' ' ' ASP . 54.8 mt-10 -64.9 -41.61 95.46 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.211 0.529 . . . . 0.0 110.477 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.703 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.53 -40.53 85.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.924 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.017 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -58.37 -38.95 78.3 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.719 HG12 ' HG3' ' A' ' 83' ' ' ARG . 47.1 t -61.57 -40.01 85.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.895 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.866 ' SD ' HG21 ' A' ' 64' ' ' VAL . 32.4 mtm -58.36 -39.97 80.99 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.559 ' O ' ' HG3' ' A' ' 85' ' ' MET . 23.8 mmt -61.35 -43.86 98.15 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.011 0.434 . . . . 0.0 110.583 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.755 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 0.2 OUTLIER -76.27 -30.8 20.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.363 179.354 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.719 ' HG3' HG12 ' A' ' 79' ' ' VAL . 25.9 mtp180 -60.01 -44.6 94.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.12 0.486 . . . . 0.0 110.045 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 70.8 m -69.61 -39.82 77.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.531 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.755 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 74.1 mtm -61.9 -40.82 96.77 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.477 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.569 ' O ' ' O ' ' A' ' 87' ' ' ASP . 12.3 tptt -62.97 -42.64 99.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.156 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.569 ' O ' ' O ' ' A' ' 86' ' ' LYS . 62.1 t0 54.36 127.63 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.668 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.18 -41.24 96.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.701 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 75.7 m -63.08 -40.04 96.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.453 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 89' ' ' SER . 0.0 OUTLIER 71.38 -93.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.321 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -146.57 7.51 1.3 Allowed Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -72.09 149.41 44.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.783 0.325 . . . . 0.0 110.94 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -90.42 107.04 18.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.62 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.532 ' HE2' ' O ' ' A' ' 139' ' ' LYS . 0.0 OUTLIER -178.9 59.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.769 179.92 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.523 ' HB3' ' HD2' ' A' ' 141' ' ' PRO . 63.3 mtm180 -151.41 168.96 10.1 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.91 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.58 ' O ' ' OG1' ' A' ' 142' ' ' THR . 21.5 Cg_exo -64.69 -45.81 8.02 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 123.029 2.486 . . . . 0.0 112.319 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.58 ' OG1' ' O ' ' A' ' 141' ' ' PRO . 0.7 OUTLIER -175.57 -137.9 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.591 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 76.2 mt -102.32 10.37 39.2 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.657 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -64.71 141.23 58.85 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.577 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.441 ' HD3' ' H ' ' A' ' 145' ' ' ARG . 0.0 OUTLIER -149.68 148.71 29.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.446 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 146' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 147' ' ' ARG . 23.2 t -129.8 -33.4 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.102 0.477 . . . . 0.0 110.226 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.643 ' O ' ' C ' ' A' ' 148' ' ' ILE . 0.0 OUTLIER -38.74 106.94 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.086 -179.865 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 1.007 HD12 ' SD ' ' A' ' 45' ' ' MET . 21.1 tt -12.41 84.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.579 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.622 ' O ' ' CB ' ' A' ' 153' ' ' MET . 45.0 t -36.41 107.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.925 -179.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.2 87.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.879 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.526 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 65.3 m-20 -55.43 -71.31 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.41 0.624 . . . . 0.0 110.669 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.498 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -62.31 -34.52 76.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.758 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.785 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 6.2 ttt -50.87 -48.92 60.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.449 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.667 ' SD ' ' CD2' ' A' ' 20' ' ' PHE . 1.8 mtp -70.75 -27.89 64.28 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.285 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 86.4 mt-30 -59.37 -45.67 90.8 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.156 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ALA . . . . . 0.819 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -75.98 -29.32 58.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.253 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 1.102 HD11 ' CE1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -60.27 -40.18 89.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.689 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.577 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 65.9 mt -86.02 -8.5 57.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.988 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.613 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 71.44 30.68 66.5 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 75.57 40.73 0.29 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.792 0.33 . . . . 0.0 110.487 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.577 ' HB2' ' HB3' ' A' ' 158' ' ' LEU . 0.1 OUTLIER -59.2 -73.81 0.08 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.753 -179.793 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -162.88 -178.31 6.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.665 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -118.79 -137.0 0.34 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.668 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -79.87 -161.31 22.94 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.768 -0.933 . . . . 0.0 110.768 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -72.59 -15.42 61.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.812 0.339 . . . . 0.0 110.385 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.91 -88.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.617 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' HIS . . . . . 0.491 ' HB3' ' O ' ' A' ' 170' ' ' HIS . 97.4 m-70 -116.88 19.15 14.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.561 ' CG ' ' H ' ' A' ' 169' ' ' HIS . 21.2 t-160 47.48 -123.99 1.56 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.531 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' HIS . . . . . 0.561 ' H ' ' CG ' ' A' ' 168' ' ' HIS . 54.4 p-80 -96.6 -9.28 29.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.805 0.335 . . . . 0.0 110.624 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' HIS . . . . . 0.5 ' ND1' ' CE1' ' A' ' 169' ' ' HIS . 46.9 p-80 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.802 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.528 ' S1 ' ' HG2' ' A' ' 60' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.821 ' CE ' HG21 ' A' ' 79' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -92.22 114.28 26.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.222 0.534 . . . . 0.0 110.717 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -63.32 -39.12 93.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.437 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.579 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -54.24 -47.06 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 121.429 0.633 . . . . 0.0 109.527 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.658 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 22.5 m-30 -71.05 -31.8 68.34 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.373 0.606 . . . . 0.0 109.584 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -57.17 -45.03 84.03 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.017 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -63.98 -35.89 82.18 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.177 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -56.48 -40.38 74.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.641 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.744 HG13 ' HG ' ' A' ' 78' ' ' LEU . 79.7 t -62.07 -46.59 96.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.69 -24.35 63.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.628 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 23.5 mm100 -70.38 -36.94 74.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.635 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.872 HD12 HD11 ' A' ' 78' ' ' LEU . 23.4 mt -59.9 110.35 1.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.498 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.712 HG23 ' H ' ' A' ' 16' ' ' GLN . 5.0 t -53.92 177.88 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.186 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 24.0 pt-20 -56.98 -37.48 71.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.694 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 79.3 tt0 -75.4 -46.93 29.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.197 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.712 ' H ' HG23 ' A' ' 13' ' ' THR . 14.1 mt-30 -59.85 -48.51 81.39 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.794 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.462 ' CG ' ' HZ ' ' A' ' 74' ' ' PHE . 26.1 ttmt -65.6 -33.36 75.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 66.6 t30 -60.55 -43.44 97.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.292 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.544 ' O ' ' HE3' ' A' ' 154' ' ' MET . 1.1 tt0 -62.05 -51.78 66.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.408 0.623 . . . . 0.0 109.905 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.679 ' CD1' HD13 ' A' ' 12' ' ' LEU . 68.7 m-85 -65.31 -37.76 88.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.053 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -58.01 -40.8 81.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.737 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 1.046 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -61.01 -41.83 97.29 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.99 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -60.05 -38.6 83.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.052 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.861 ' O ' HG22 ' A' ' 28' ' ' VAL . 41.6 t80 -57.37 -48.83 78.02 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.553 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 29' ' ' LEU . 67.0 t0 -61.55 -41.3 97.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.312 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 1.046 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -59.54 -45.38 93.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.535 179.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.751 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 16.0 m-85 -61.13 -40.54 94.18 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.353 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.861 HG22 ' O ' ' A' ' 24' ' ' PHE . 15.0 m -104.27 23.82 2.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.419 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.613 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -52.67 106.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 -179.61 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.34 7.01 67.9 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.539 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -65.52 135.59 55.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.743 0.306 . . . . 0.0 110.389 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.99 -41.39 95.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.175 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.3 p30 -96.91 -19.6 18.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.845 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.631 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 86.97 -8.62 75.57 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.6 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 54.6 p -80.91 136.42 36.05 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.745 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.5 mt -72.94 104.75 2.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.834 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.625 ' HB3' HG22 ' A' ' 71' ' ' THR . 87.2 p -99.79 159.96 14.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.549 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.751 ' N ' HD11 ' A' ' 61' ' ' ILE . 1.3 p -41.57 -32.59 0.37 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.35 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -74.73 -43.42 55.09 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.172 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.653 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . 4.8 mm-40 -74.49 -21.97 59.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.344 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.601 HD22 HD22 ' A' ' 57' ' ' LEU . 3.4 tt -83.32 -50.15 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.839 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.529 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.48 -37.13 94.18 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.653 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -46.4 -59.89 2.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 117.236 0.518 . . . . 0.0 109.986 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.751 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 9.6 t -62.03 -34.09 61.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . 1.02 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.5 mmm -58.5 -43.31 89.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.009 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.618 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 21.7 mtt180 -67.24 -32.48 73.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.192 0.52 . . . . 0.0 109.73 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.616 ' HE1' HG22 ' A' ' 44' ' ' VAL . 26.0 mtm -60.79 -37.18 81.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.063 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.678 HD13 ' HA ' ' A' ' 153' ' ' MET . 57.3 mt -89.79 3.84 51.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.537 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.6 -3.62 57.74 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.618 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 8.2 mm100 -85.31 129.52 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.787 0.327 . . . . 0.0 111.137 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -129.19 61.44 57.14 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.906 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.748 ' CG ' HD21 ' A' ' 57' ' ' LEU . 58.7 Cg_endo -73.8 143.86 34.07 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 C-N-CA 122.542 2.161 . . . . 0.0 112.29 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.4 p -73.63 156.98 88.19 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 121.202 0.525 . . . . 0.0 110.551 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.85 -40.24 73.98 Favored 'Trans proline' 0 C--N 1.299 -2.059 0 C-N-CA 122.791 2.327 . . . . 0.0 112.017 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 52.5 mp0 -62.69 -40.4 97.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.391 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 60' ' ' MET . 1.6 tp10 -78.52 -37.77 42.27 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.44 0.638 . . . . 0.0 109.788 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.748 HD21 ' CG ' ' A' ' 52' ' ' PRO . 33.0 mt -61.05 -35.65 77.48 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.476 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -41.77 88.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.403 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -63.47 -41.67 98.59 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 110.028 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.502 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -65.14 -40.99 95.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.751 HD11 ' N ' ' A' ' 38' ' ' THR . 2.6 mt -61.61 -47.09 94.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.803 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.628 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 39.1 t70 -60.28 -29.37 68.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.719 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -54.23 -38.18 65.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.208 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.829 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 2.2 m -110.51 0.86 9.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.044 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.628 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 57.3 t0 -85.2 109.21 18.15 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.128 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.48 -49.09 72.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.982 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.555 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 51.8 p30 -89.34 -6.18 56.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.755 0.312 . . . . 0.0 110.673 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.447 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 65.66 27.04 72.25 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.615 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.1 p -68.52 4.22 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.858 0.361 . . . . 0.0 110.73 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.55 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.77 16.08 80.48 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.625 HG22 ' HB3' ' A' ' 37' ' ' SER . 4.6 p -141.31 128.91 21.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.745 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -98.95 103.91 15.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.448 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.59 ' OD1' ' CB ' ' A' ' 35' ' ' SER . 66.4 m-20 -74.58 -164.96 0.31 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.39 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 1.001 ' HE1' HD23 ' A' ' 78' ' ' LEU . 4.4 t80 -57.21 -48.48 78.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.63 -48.39 75.05 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.784 0.326 . . . . 0.0 110.823 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.615 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 52.5 mt-10 -62.36 -41.68 98.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.289 0.566 . . . . 0.0 110.463 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.731 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.51 -41.15 84.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.057 0.456 . . . . 0.0 109.823 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.001 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -56.07 -40.65 73.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.595 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.821 HG21 ' CE ' ' A' ' 1' ' ' MET . 43.9 t -61.08 -42.62 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.509 ' HB2' HG11 ' A' ' 64' ' ' VAL . 4.3 ttm -52.22 -44.77 64.99 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.666 ' O ' ' SD ' ' A' ' 85' ' ' MET . 33.6 mmt -60.28 -46.3 90.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.998 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.7 ' HA ' ' HE2' ' A' ' 85' ' ' MET . 0.2 OUTLIER -74.83 -26.87 19.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.653 179.511 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.658 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 83.4 mtt-85 -60.16 -44.79 94.72 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.984 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.579 ' O ' ' N ' ' A' ' 88' ' ' ASP . 79.4 p -92.74 -17.58 24.03 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.483 179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.7 ' HE2' ' HA ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -66.27 -46.06 78.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -60.93 -43.33 98.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.212 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.478 ' OD1' ' HA ' ' A' ' 84' ' ' SER . 54.4 p30 -104.94 18.1 22.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.38 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.579 ' N ' ' O ' ' A' ' 84' ' ' SER . 65.3 t0 -59.05 -46.15 88.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.46 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.636 ' O ' ' C ' ' A' ' 90' ' ' LYS . 69.6 m 43.13 26.45 0.09 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.596 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.636 ' C ' ' O ' ' A' ' 89' ' ' SER . 5.4 ptmt -0.53 -111.24 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.737 0.648 . . . . 0.0 110.864 -179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 81.97 174.16 49.3 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.68 -67.63 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.794 0.331 . . . . 0.0 110.398 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -123.89 -15.3 6.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.665 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -102.74 -17.21 15.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.945 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.56 ' HB3' ' HD2' ' A' ' 141' ' ' PRO . 0.7 OUTLIER -116.6 175.25 2.03 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.826 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.56 ' HD2' ' HB3' ' A' ' 140' ' ' ARG . 32.9 Cg_exo -60.54 149.66 85.66 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 123.377 2.718 . . . . 0.0 112.369 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.627 HG23 ' N ' ' A' ' 143' ' ' LEU . 6.4 t -70.91 -129.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.318 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.627 ' N ' HG23 ' A' ' 142' ' ' THR . 42.1 mt 84.67 173.03 0.07 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.876 0.369 . . . . 0.0 110.578 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -83.81 -111.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.259 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 51.06 41.39 27.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.518 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' VAL . . . . . 0.416 ' O ' ' O ' ' A' ' 147' ' ' ARG . 21.2 t -87.26 -47.92 15.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.565 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.416 ' O ' ' O ' ' A' ' 146' ' ' VAL . 2.4 mpt_? 41.8 -164.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.406 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 1.02 HD12 ' SD ' ' A' ' 45' ' ' MET . 19.3 tt -70.4 76.72 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.195 0.521 . . . . 0.0 110.366 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.578 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -34.54 107.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.278 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.471 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.73 -39.19 83.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -43.28 -84.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.346 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.435 ' HA ' ' HB2' ' A' ' 155' ' ' GLN . . . -61.19 -33.91 74.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.226 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.679 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 6.3 ttt -48.22 -49.78 31.78 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.288 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.99 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 3.6 mtp -76.42 -27.04 56.13 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.534 179.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 76.0 mt-30 -60.37 -43.19 96.81 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.338 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ALA . . . . . 0.627 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -64.1 -44.68 91.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.024 0.44 . . . . 0.0 110.682 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.633 ' N ' HD23 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -62.46 -43.17 99.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.582 -179.287 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.729 HD21 ' HB3' ' A' ' 22' ' ' ALA . 90.1 mt -82.57 -13.58 56.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.231 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.637 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 59.04 31.12 68.0 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 76.5 -6.48 2.0 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.654 0.264 . . . . 0.0 110.681 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.59 ' O ' ' O ' ' A' ' 162' ' ' ALA . 6.7 ptm180 27.76 36.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.755 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.623 ' N ' ' O ' ' A' ' 160' ' ' ALA . . . 51.42 121.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.928 0.394 . . . . 0.0 110.497 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -59.42 127.01 29.96 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.509 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' GLY . . . . . 0.537 ' O ' ' CB ' ' A' ' 165' ' ' HIS . . . -82.41 165.41 44.62 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.537 ' CB ' ' O ' ' A' ' 164' ' ' GLY . 0.0 OUTLIER 158.82 -67.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.802 0.335 . . . . 0.0 110.702 179.659 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -153.32 160.55 42.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.734 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -159.8 162.27 34.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.818 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -150.24 -156.38 0.71 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.552 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 35.1 p-80 -59.62 -9.34 2.55 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.416 -179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.566 -179.941 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.829 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.558 ' O ' ' O ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.558 ' O ' ' O ' ' A' ' 1' ' ' MET . 4.5 m-20 40.7 101.74 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.98 0.419 . . . . 0.0 110.592 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 97.0 m-20 -60.36 -38.43 83.82 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.582 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -53.37 -46.67 58.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.271 -0.571 . . . . 0.0 109.651 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.6 m-30 -71.29 -29.69 65.36 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.73 -45.73 88.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.07 -34.56 78.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.288 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -58.12 -40.83 82.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.847 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.873 HG22 HD12 ' A' ' 78' ' ' LEU . 94.0 t -62.87 -45.52 98.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -69.94 -26.98 64.39 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.412 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 12.1 mm100 -69.57 -37.9 77.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.588 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.738 HD12 HD11 ' A' ' 78' ' ' LEU . 20.2 mt -56.36 128.49 36.16 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.281 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.727 HG23 ' H ' ' A' ' 16' ' ' GLN . 9.0 t -63.65 179.4 0.48 Allowed 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.092 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -61.4 -41.1 96.6 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.464 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -69.93 -42.12 73.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.84 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.727 ' H ' HG23 ' A' ' 13' ' ' THR . 71.4 mt-30 -61.89 -43.5 98.72 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 5.8 mtmt -71.96 -30.18 65.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.813 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -62.2 -49.05 77.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.227 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.583 ' O ' ' CE ' ' A' ' 154' ' ' MET . 64.4 mt-10 -63.14 -44.72 94.77 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.418 0.627 . . . . 0.0 110.37 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.65 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 39.0 m-85 -67.74 -37.07 81.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.674 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 29.1 tptp -60.78 -40.32 92.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.846 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 1.04 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.01 -42.97 95.45 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.76 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.851 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.07 -39.62 90.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.825 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.654 ' O ' HG22 ' A' ' 28' ' ' VAL . 16.3 t80 -56.65 -48.8 76.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.645 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 29' ' ' LEU . 6.3 t70 -61.72 -41.67 97.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.827 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 1.04 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.26 -44.46 83.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.667 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.984 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 21.3 m-85 -61.92 -40.96 97.27 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.342 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.693 HG13 HG12 ' A' ' 36' ' ' ILE . 31.4 m -106.46 25.38 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.458 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.764 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -54.0 111.17 0.7 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.253 -179.519 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.84 3.06 83.67 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.511 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -62.66 136.6 57.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.353 . . . . 0.0 110.301 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 61.9 mp0 -64.81 -40.31 94.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.459 ' OD1' ' HB3' ' A' ' 35' ' ' SER . 11.0 t70 -96.98 -22.81 16.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.741 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.646 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 89.07 -8.85 78.88 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.592 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 81.4 p -79.69 136.46 36.79 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.759 ' HB ' HG13 ' A' ' 72' ' ' VAL . 94.6 mt -73.77 104.15 2.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.551 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 83.5 p -97.01 168.09 10.67 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.073 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.777 HG22 ' HB3' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -49.16 -38.21 24.83 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.552 -179.471 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.45 -49.17 57.53 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.133 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.551 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 1.4 mp0 -64.51 -43.83 92.83 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.07 0.462 . . . . 0.0 110.743 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.726 HD22 ' HE1' ' A' ' 60' ' ' MET . 4.0 tt -64.98 -49.81 68.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.133 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.58 -31.83 79.17 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.118 -1.193 . . . . 0.0 110.118 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.519 ' HE3' ' O ' ' A' ' 26' ' ' ILE . 0.0 OUTLIER -54.33 -54.05 45.56 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 1.032 HG22 ' SD ' ' A' ' 47' ' ' MET . 1.1 t -66.1 -32.22 57.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.975 ' SD ' HD12 ' A' ' 148' ' ' ILE . 89.5 mmm -59.18 -43.38 92.19 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 78.5 mtp85 -66.98 -37.85 84.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.703 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . 1.032 ' SD ' HG22 ' A' ' 44' ' ' VAL . 1.3 ptm -55.08 -29.15 56.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.488 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 148' ' ' ILE . 32.0 mt -94.79 0.02 54.56 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.808 -179.486 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.42 5.64 54.02 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.708 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 14.8 mm100 -88.86 135.68 33.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.926 0.393 . . . . 0.0 111.242 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.53 ' ND2' HH12 ' A' ' 46' ' ' ARG . 51.4 t-20 -128.67 60.45 49.25 Favored Pre-proline 0 C--N 1.32 -0.705 0 C-N-CA 119.474 -0.891 . . . . 0.0 111.089 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.765 ' HG2' HD11 ' A' ' 57' ' ' LEU . 71.6 Cg_endo -77.05 144.69 24.04 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 C-N-CA 122.659 2.239 . . . . 0.0 112.471 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 p -80.68 153.53 73.2 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.101 0.477 . . . . 0.0 110.458 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.31 -36.69 94.19 Favored 'Trans proline' 0 C--N 1.3 -2.0 0 C-N-CA 122.792 2.328 . . . . 0.0 111.978 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.4 mp0 -62.45 -39.87 94.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.433 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -81.96 -34.42 29.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.908 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.777 ' HB3' HG22 ' A' ' 38' ' ' THR . 32.6 mt -64.93 -39.24 93.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.851 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.501 ' N ' ' CG2' ' A' ' 38' ' ' THR . 7.1 mt-30 -53.53 -50.18 66.02 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.839 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -62.92 -44.05 97.12 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.582 0.706 . . . . 0.0 109.953 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.726 ' HE1' HD22 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -58.52 -42.91 88.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.134 179.104 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.732 HD11 ' N ' ' A' ' 38' ' ' THR . 3.2 mt -60.61 -47.72 91.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.971 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.649 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 18.7 t70 -56.54 -22.31 32.27 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.578 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' MET . 51.6 tp10 -49.97 -39.54 41.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.761 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 0.8 OUTLIER -115.1 -4.97 11.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.911 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.649 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 53.4 t0 -72.04 114.81 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.602 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -64.63 -46.5 82.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.58 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 59.5 p30 -94.06 -6.27 45.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.868 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 70' ' ' GLY . . . 68.12 23.1 74.61 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.612 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.4 p -69.61 5.72 1.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.836 0.35 . . . . 0.0 110.699 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.683 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.68 17.52 80.0 Favored Glycine 0 CA--C 1.518 0.257 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.592 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.1 p -138.71 122.37 17.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.922 0.392 . . . . 0.0 111.106 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.759 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -99.97 106.19 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.195 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.7 m-20 -73.62 -166.79 0.39 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.507 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.979 ' HE1' HD23 ' A' ' 78' ' ' LEU . 0.8 OUTLIER -57.85 -51.09 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.248 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -63.14 -43.51 98.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.859 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.635 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 68.6 mt-10 -64.62 -39.04 93.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.672 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -72.35 -39.18 68.3 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.198 0.523 . . . . 0.0 110.279 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.979 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.7 -36.58 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -179.352 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.637 ' O ' HG13 ' A' ' 82' ' ' VAL . 48.8 t -59.95 -40.43 82.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.315 0.578 . . . . 0.0 109.732 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.425 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 9.5 ttt -57.2 -43.09 82.4 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.857 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.692 ' O ' ' SD ' ' A' ' 85' ' ' MET . 38.8 mmt -60.19 -47.5 85.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.113 0.482 . . . . 0.0 110.547 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.657 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER -69.77 -31.05 47.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.377 179.231 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.642 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 90.6 mtt-85 -59.22 -39.84 83.95 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.216 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.7 p -85.0 -20.7 30.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.647 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.692 ' SD ' ' O ' ' A' ' 81' ' ' MET . 0.2 OUTLIER -66.3 -40.41 89.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.762 179.435 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -62.67 -42.57 99.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.489 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -61.23 -46.39 90.6 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.611 ' OD1' ' N ' ' A' ' 89' ' ' SER . 22.1 p30 -73.1 -20.74 60.88 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.862 0.363 . . . . 0.0 110.5 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.611 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 2.1 t 52.42 -81.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.795 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' A' ' 88' ' ' ASP . 1.9 ptmt -83.65 24.5 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.808 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -102.18 101.1 2.11 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.483 ' O ' ' CD1' ' A' ' 138' ' ' PHE . 18.9 mtpp -95.49 -51.14 4.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 0.0 110.435 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.483 ' CD1' ' O ' ' A' ' 137' ' ' LYS . 0.2 OUTLIER 164.78 20.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.763 179.862 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 140' ' ' ARG . 5.6 mmmt -59.89 -159.54 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.594 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.492 ' HD3' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -63.61 169.84 3.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.209 0.528 . . . . 0.0 110.095 -179.705 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.492 ' HD2' ' HD3' ' A' ' 140' ' ' ARG . 19.3 Cg_exo -64.4 107.77 0.89 Allowed 'Trans proline' 0 C--N 1.301 -1.954 0 C-N-CA 122.968 2.446 . . . . 0.0 111.422 -178.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.5 m -86.19 -132.52 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.441 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 86.3 mt -83.48 137.73 33.76 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.369 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 8.0 ptp180 -72.85 143.09 47.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.601 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -120.36 156.95 30.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.716 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 28.0 m -60.85 -24.56 32.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.546 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -75.18 149.79 38.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.688 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.975 HD12 ' SD ' ' A' ' 45' ' ' MET . 15.9 tt -45.4 103.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.346 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.504 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.7 OUTLIER -38.49 102.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.249 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.473 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.66 -39.64 89.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.725 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 3.5 t0 -45.89 -79.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.134 0.492 . . . . 0.0 110.659 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.53 77.36 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.762 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.599 ' O ' ' HG ' ' A' ' 157' ' ' LEU . 11.0 ttt -48.0 -51.6 23.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.323 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.851 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.6 mtp -70.44 -30.16 66.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.363 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 73.4 mt-30 -60.8 -42.54 97.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.022 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ALA . . . . . 0.448 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -64.02 -43.79 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.486 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.806 HD22 HG21 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -66.49 -42.79 86.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.675 -179.32 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.502 HD21 ' HB3' ' A' ' 22' ' ' ALA . 75.1 mt -79.43 -8.05 58.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.194 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 61.54 31.23 76.93 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 67.12 26.73 8.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.905 0.383 . . . . 0.0 110.507 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 158' ' ' LEU . 14.8 mtm180 -62.08 117.75 6.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.934 0.397 . . . . 0.0 110.525 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . 54.05 17.69 1.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.609 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 4.0 mptt -139.03 111.54 7.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.375 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' GLY . . . . . 0.441 ' O ' ' CB ' ' A' ' 165' ' ' HIS . . . 106.67 156.41 21.03 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.441 ' CB ' ' O ' ' A' ' 164' ' ' GLY . 0.0 OUTLIER 165.82 -29.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.499 -179.834 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.575 ' O ' ' O ' ' A' ' 167' ' ' HIS . 56.2 p-80 -67.39 -175.44 0.49 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.447 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 167' ' ' HIS . . . . . 0.575 ' O ' ' O ' ' A' ' 166' ' ' HIS . 1.9 t-160 -27.51 148.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.317 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -51.3 142.34 13.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.269 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' HIS . . . . . 0.568 ' O ' ' HB2' ' A' ' 170' ' ' HIS . 32.8 p80 -78.39 2.32 19.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.75 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 170' ' ' HIS . . . . . 0.568 ' HB2' ' O ' ' A' ' 169' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.546 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.761 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.565 ' HG3' ' CB ' ' A' ' 66' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.411 ' O ' ' O ' ' A' ' 1' ' ' MET . 80.3 m-20 44.09 93.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.474 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.85 -40.77 76.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.33 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.597 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -52.45 -47.18 47.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.422 0.63 . . . . 0.0 110.098 179.273 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.692 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 22.9 m-30 -70.3 -32.04 69.64 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -44.02 85.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.491 0.662 . . . . 0.0 109.223 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.78 76.73 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.255 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.86 -40.33 79.92 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.867 HG13 ' HG ' ' A' ' 78' ' ' LEU . 83.8 t -62.84 -45.36 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.42 -23.81 62.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.395 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.38 -34.63 70.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.842 -179.159 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.782 HD13 ' CE1' ' A' ' 20' ' ' PHE . 15.7 mt -61.55 123.99 19.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.575 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.648 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -60.88 -179.14 0.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.659 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.534 ' N ' ' OG1' ' A' ' 13' ' ' THR . 49.3 tp10 -60.34 -48.37 82.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.892 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -65.69 -43.25 89.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.012 0.434 . . . . 0.0 110.847 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.648 ' H ' HG23 ' A' ' 13' ' ' THR . 15.8 mt-30 -58.17 -50.83 72.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.748 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HD3' ' HZ ' ' A' ' 74' ' ' PHE . 21.3 ttmt -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.955 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -61.11 -46.32 91.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.082 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.478 ' O ' ' HE3' ' A' ' 154' ' ' MET . 0.4 OUTLIER -64.64 -46.08 84.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.487 0.661 . . . . 0.0 110.168 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.782 ' CE1' HD13 ' A' ' 12' ' ' LEU . 43.8 m-85 -62.34 -37.11 84.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.735 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.414 ' NZ ' ' HB2' ' A' ' 74' ' ' PHE . 57.8 tptt -58.56 -38.89 78.81 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 1.078 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.32 -41.56 93.78 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.962 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.67 -38.71 88.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.851 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.866 ' O ' HG22 ' A' ' 28' ' ' VAL . 14.1 t80 -58.29 -49.27 77.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.768 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' A' ' 29' ' ' LEU . 57.4 t0 -61.97 -40.79 96.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 1.078 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -57.91 -44.78 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.812 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.849 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 16.7 m-85 -63.46 -38.12 89.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.049 0.452 . . . . 0.0 110.504 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.866 HG22 ' O ' ' A' ' 24' ' ' PHE . 6.9 m -104.71 21.09 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.684 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.546 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -55.76 101.76 0.06 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.384 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.88 5.06 54.05 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.42 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -69.14 139.17 54.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.682 0.277 . . . . 0.0 110.62 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -66.79 -42.33 86.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.305 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.488 ' OD2' ' OG ' ' A' ' 35' ' ' SER . 56.4 p-10 -99.98 -15.49 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.861 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 89.28 -8.63 79.41 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.621 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 52.7 p -75.73 135.47 40.35 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.829 ' CG1' HG13 ' A' ' 28' ' ' VAL . 85.4 mt -74.71 106.22 4.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.612 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 38.7 t -101.26 157.87 16.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.068 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.656 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -39.16 -43.53 1.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.53 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.11 -41.75 90.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 110.361 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.624 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 6.9 mp0 -75.8 -21.7 57.08 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.454 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.603 ' O ' ' HG2' ' A' ' 45' ' ' MET . 2.6 tt -83.84 -47.94 10.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.842 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.542 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.09 -38.99 96.49 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.624 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.74 -57.87 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.152 0.501 . . . . 0.0 110.283 179.347 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.746 HG11 ' CE1' ' A' ' 27' ' ' PHE . 37.1 t -62.56 -35.02 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.056 177.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.603 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 90.5 mmm -56.53 -43.18 79.58 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.748 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 50.9 mtp180 -64.44 -35.49 81.1 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.074 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.512 ' HE2' ' HA ' ' A' ' 44' ' ' VAL . 19.1 mtm -60.32 -28.59 68.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.116 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.648 HD21 ' HB3' ' A' ' 156' ' ' ALA . 24.7 mt -95.81 5.56 51.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.222 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 95.73 -2.14 64.24 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.592 -1.003 . . . . 0.0 110.592 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.748 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -84.76 135.93 33.92 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 110.869 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.456 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 24.1 p30 -129.97 58.83 40.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.223 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.537 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 65.8 Cg_endo -80.33 146.54 17.6 Favored 'Trans proline' 0 C--N 1.304 -1.808 0 C-N-CA 122.787 2.325 . . . . 0.0 111.926 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 p -80.02 153.08 74.79 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.62 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.23 -40.8 79.8 Favored 'Trans proline' 0 C--N 1.301 -1.93 0 C-N-CA 122.839 2.359 . . . . 0.0 112.081 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.5 mp0 -62.49 -39.32 93.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.29 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.512 ' O ' ' HE1' ' A' ' 60' ' ' MET . 0.2 OUTLIER -80.54 -34.14 35.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.42 179.65 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.586 ' HB3' HG22 ' A' ' 38' ' ' THR . 16.3 mt -62.04 -29.48 70.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.713 179.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.44 -36.4 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.46 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -62.27 -48.75 78.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 0.0 110.901 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.658 ' N ' ' SD ' ' A' ' 60' ' ' MET . 2.0 mpp? -63.53 -39.48 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.524 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.656 HD11 ' N ' ' A' ' 38' ' ' THR . 1.5 mt -61.96 -44.74 99.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.193 0.52 . . . . 0.0 110.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.561 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.9 t70 -59.01 -35.48 73.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.587 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -51.5 -42.46 61.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.684 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.647 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 3.1 m -106.63 3.54 10.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.681 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.561 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 34.5 t70 -107.74 90.34 3.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.366 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.565 ' CB ' ' HG3' ' A' ' 1' ' ' MET . 40.5 tt0 -79.57 -19.18 50.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.37 -11.95 60.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.643 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.48 19.09 68.48 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.0 p -86.32 -7.9 58.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.832 0.348 . . . . 0.0 110.875 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.555 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 74.06 17.45 79.48 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.626 -0.989 . . . . 0.0 110.626 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.621 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.1 p -137.48 128.59 27.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.044 0.449 . . . . 0.0 110.613 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.806 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -97.58 105.43 17.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.503 179.649 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.0 m-20 -74.11 -161.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.69 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 1.034 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.7 t80 -58.79 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.874 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.62 -42.48 98.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.632 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.557 ' C ' HG23 ' A' ' 72' ' ' VAL . 48.0 mt-10 -66.37 -41.38 89.53 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.311 0.577 . . . . 0.0 110.577 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.784 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.85 -37.83 82.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.936 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.034 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -59.1 -40.68 86.06 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.692 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.591 ' O ' HG13 ' A' ' 82' ' ' VAL . 53.8 t -62.15 -39.21 83.09 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.094 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.587 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.453 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 1.4 ttm -57.02 -42.99 81.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.249 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.514 ' O ' ' HE2' ' A' ' 85' ' ' MET . 22.1 mmt -60.51 -45.38 94.0 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.035 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.636 HG12 ' O ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -75.85 -27.63 18.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.494 178.768 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.692 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 3.4 mtt85 -64.87 -39.25 93.25 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.911 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.793 ' OG ' HG21 ' A' ' 146' ' ' VAL . 37.0 t -86.47 -48.24 8.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.988 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.625 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 3.6 ptp -62.64 -17.99 61.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.562 -179.074 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 82' ' ' VAL . 57.7 tptt -54.81 -34.62 62.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.472 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.562 ' HA ' ' HB3' ' A' ' 90' ' ' LYS . 58.9 p30 -60.17 -19.99 56.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.415 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.56 ' N ' ' OD1' ' A' ' 87' ' ' ASP . 97.9 m-20 -63.28 -40.0 96.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.645 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 61.6 p -119.04 14.53 13.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.888 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.562 ' HB3' ' HA ' ' A' ' 87' ' ' ASP . 10.0 pttp -71.25 179.2 2.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.503 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.422 ' N ' ' HG3' ' A' ' 90' ' ' LYS . . . 75.55 -167.61 54.79 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 138' ' ' PHE . 14.6 mptt 59.49 93.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.689 0.281 . . . . 0.0 110.571 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.482 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 16.9 m-85 66.84 13.58 9.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.767 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -136.78 144.85 43.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.678 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.547 ' HB2' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -74.62 171.55 11.16 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.351 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.547 ' HD2' ' HB2' ' A' ' 140' ' ' ARG . 48.2 Cg_endo -83.3 78.69 3.11 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 123.29 2.66 . . . . 0.0 112.312 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.2 m -59.96 -45.95 90.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.447 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 39.8 mt -142.6 71.7 1.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.6 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 144' ' ' ARG . 7.7 ptm180 -59.18 128.57 37.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? 61.2 156.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.372 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' VAL . . . . . 0.793 HG21 ' OG ' ' A' ' 84' ' ' SER . 10.4 p -141.97 152.21 18.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.693 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -95.2 -46.01 6.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.644 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.601 HG22 ' O ' ' A' ' 148' ' ' ILE . 0.1 OUTLIER -78.19 118.41 25.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.483 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.62 ' O ' ' CB ' ' A' ' 153' ' ' MET . 12.5 m -87.95 102.2 14.5 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -52.48 -34.99 51.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.413 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 16.2 t0 -56.79 -80.07 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.231 0.539 . . . . 0.0 110.456 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.554 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -61.57 -34.36 75.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.849 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 4.9 ttt -45.64 -61.45 1.7 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.073 0.463 . . . . 0.0 110.252 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.962 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 6.5 mtp -63.91 -28.19 69.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.185 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 72.8 mt-30 -60.75 -40.64 93.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.194 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ALA . . . . . 0.648 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -65.0 -39.92 94.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.392 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.768 ' CB ' HD13 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -73.89 -46.47 44.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.583 -179.494 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 154' ' ' MET . 83.9 mt -70.3 -41.27 73.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.828 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 160' ' ' ALA . . . 102.55 -48.61 1.04 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 159' ' ' GLY . . . 175.11 43.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.551 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.766 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 3.8 mmm180 -76.91 153.21 34.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.509 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 161' ' ' ARG . . . 91.65 101.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.903 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 26.4 mtmt -64.3 -37.94 89.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.625 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' GLY . . . . . 0.572 ' O ' ' HB2' ' A' ' 165' ' ' HIS . . . 70.99 -117.57 6.96 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.801 -0.92 . . . . 0.0 110.801 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.572 ' HB2' ' O ' ' A' ' 164' ' ' GLY . 60.7 m170 73.33 76.88 0.14 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.995 0.426 . . . . 0.0 110.853 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -93.04 138.1 31.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.522 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 12.2 m170 -64.64 148.64 50.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.83 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -72.97 160.26 32.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.375 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -59.06 -45.09 91.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.358 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.385 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.544 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.647 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -70.07 113.08 6.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.442 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.11 -39.89 91.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.291 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.622 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -54.1 -47.79 66.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.351 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.633 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 22.9 m-30 -71.66 -31.86 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -46.09 82.91 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.538 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.4 -35.61 81.45 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.551 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -57.32 -40.37 77.78 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.831 HG22 HD12 ' A' ' 78' ' ' LEU . 92.3 t -61.07 -47.14 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -69.12 -30.65 68.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.095 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 92.4 mm-40 -69.4 -36.56 76.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.924 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.81 HD12 HD11 ' A' ' 78' ' ' LEU . 13.5 mt -51.4 125.37 14.18 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.797 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.937 HG23 ' H ' ' A' ' 16' ' ' GLN . 9.9 t -60.66 167.9 2.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.259 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.538 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.8 tm-20 -60.08 -42.27 94.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.777 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -70.8 -50.7 32.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.163 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.937 ' H ' HG23 ' A' ' 13' ' ' THR . 5.9 tt0 -61.89 -44.76 96.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.143 0.497 . . . . 0.0 110.333 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -66.56 -33.43 75.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.773 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.538 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 65.0 t30 -58.25 -42.58 86.71 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.99 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -62.67 -45.48 92.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.032 0.444 . . . . 0.0 110.051 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.655 ' HD1' HD13 ' A' ' 12' ' ' LEU . 12.8 m-85 -64.81 -38.98 92.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.343 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.7 tptp -59.68 -40.93 89.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.727 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.944 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.79 -41.77 96.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.83 -38.76 89.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.004 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.746 ' O ' HG22 ' A' ' 28' ' ' VAL . 23.2 t80 -57.4 -49.13 77.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.649 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.542 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.42 -39.16 92.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.384 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.944 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -57.06 -47.44 83.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.627 -179.772 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.904 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 25.4 m-85 -61.88 -42.27 98.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.494 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.746 HG22 ' O ' ' A' ' 24' ' ' PHE . 18.9 m -101.2 22.91 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.657 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.582 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -57.75 100.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.408 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.97 -5.58 53.45 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.458 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -60.17 138.24 57.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.835 0.35 . . . . 0.0 110.514 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.87 -41.21 91.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.996 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.66 -22.97 19.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.778 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.684 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 89.0 -9.38 77.02 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.598 ' C ' HG11 ' A' ' 28' ' ' VAL . 89.3 p -82.72 136.2 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.681 ' CG1' HG13 ' A' ' 28' ' ' VAL . 96.4 mt -69.05 104.8 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.597 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.613 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 8.9 p -98.63 156.33 16.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.715 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -39.48 -38.48 0.58 Allowed 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.481 -179.277 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.76 -46.06 76.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.976 0.417 . . . . 0.0 110.171 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.613 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 6.7 mp0 -68.75 -39.42 80.3 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.644 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.945 HD22 HD22 ' A' ' 57' ' ' LEU . 6.4 tt -60.5 -49.05 79.09 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.444 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.578 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.09 -36.27 92.69 Favored Glycine 0 CA--C 1.531 1.033 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -51.23 -62.93 1.32 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.039 0.447 . . . . 0.0 109.99 179.596 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.904 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 4.7 t -58.8 -30.88 43.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.903 178.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.689 ' HE3' ' CG ' ' A' ' 52' ' ' PRO . 81.4 mmm -59.18 -41.99 89.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.281 -0.418 . . . . 0.0 109.874 179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.695 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 77.1 mtp180 -67.61 -31.26 71.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.031 0.443 . . . . 0.0 109.847 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 44' ' ' VAL . 19.8 mtm -61.59 -35.96 79.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.098 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.692 ' CD2' ' HB3' ' A' ' 156' ' ' ALA . 11.0 mt -90.3 2.64 55.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.568 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.69 -1.0 56.72 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.695 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 28.1 mm100 -86.0 134.72 33.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.855 0.359 . . . . 0.0 110.855 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.605 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 31.8 p30 -131.41 60.1 50.17 Favored Pre-proline 0 C--N 1.326 -0.429 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.4 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.689 ' CG ' ' HE3' ' A' ' 45' ' ' MET . 3.6 Cg_exo -75.9 157.83 38.85 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 C-N-CA 123.519 2.812 . . . . 0.0 112.124 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.4 p -89.28 154.2 48.95 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.03 0.443 . . . . 0.0 110.389 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.61 -42.02 71.92 Favored 'Trans proline' 0 C--N 1.302 -1.916 0 C-N-CA 122.716 2.277 . . . . 0.0 112.031 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.16 -44.76 95.89 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.887 0.375 . . . . 0.0 110.262 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.592 ' O ' ' SD ' ' A' ' 60' ' ' MET . 54.2 tp10 -71.64 -38.53 70.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.167 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.945 HD22 HD22 ' A' ' 41' ' ' LEU . 41.9 mt -60.62 -24.11 65.25 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.759 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.435 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 34.9 tt0 -64.3 -39.9 94.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.827 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -61.1 -44.14 97.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.108 0.48 . . . . 0.0 110.758 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -67.53 -39.67 85.05 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.346 179.585 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.715 HD11 ' N ' ' A' ' 38' ' ' THR . 1.4 mt -61.52 -46.06 97.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.439 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 38.2 t70 -59.19 -37.45 77.46 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.589 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.4 tt0 -47.44 -35.03 7.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.543 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.605 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 2.5 m -118.51 6.11 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.682 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.455 ' OD2' ' N ' ' A' ' 70' ' ' GLY . 59.0 t0 -117.08 83.24 1.94 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.06 -17.42 63.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 -13.0 60.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.522 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.22 13.68 60.47 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.3 p -76.58 -12.54 60.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.698 0.285 . . . . 0.0 110.995 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.605 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 75.02 16.29 80.65 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.577 ' HA ' ' O ' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -134.48 115.24 13.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.978 0.418 . . . . 0.0 111.101 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.821 HG23 ' N ' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -90.58 105.55 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.199 179.311 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.539 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -72.69 -162.97 0.11 Allowed 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.65 179.678 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.887 ' HE1' HD23 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -58.1 -51.41 69.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.811 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.474 ' O ' HG23 ' A' ' 79' ' ' VAL . 1.2 p30 -65.33 -42.27 93.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.711 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.578 ' O ' ' HB ' ' A' ' 64' ' ' VAL . 53.0 mt-10 -62.36 -42.24 99.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.451 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.821 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -73.89 -42.86 60.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.127 0.489 . . . . 0.0 110.142 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.887 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.11 -34.77 45.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.732 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.609 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 46.4 t -60.58 -44.06 95.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.002 178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.635 ' HE3' ' CA ' ' A' ' 77' ' ' PHE . 5.2 ptp -56.97 -40.1 75.87 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.053 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.6 ' O ' ' HG3' ' A' ' 85' ' ' MET . 35.2 mmt -61.55 -45.43 94.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.146 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.813 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 0.2 OUTLIER -76.13 -25.0 16.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.213 179.158 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.633 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 62.3 mtt-85 -60.54 -41.41 94.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.718 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.477 ' O ' ' HA3' ' A' ' 136' ' ' GLY . 96.4 p -86.27 -30.61 22.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.034 0.445 . . . . 0.0 110.544 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.813 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 65.0 mtm -59.35 -33.81 71.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.73 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.475 ' C ' ' H ' ' A' ' 88' ' ' ASP . 12.8 tttm -41.79 -44.69 3.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.452 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.503 ' OD2' ' O ' ' A' ' 85' ' ' MET . 46.5 m-20 59.77 1.37 0.3 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.586 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.475 ' H ' ' C ' ' A' ' 86' ' ' LYS . 67.5 m-20 -87.69 -38.38 15.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.845 0.355 . . . . 0.0 110.493 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 70.6 m -120.36 -25.32 5.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.564 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.431 ' HE3' ' HE ' ' A' ' 147' ' ' ARG . 22.1 ptmt -156.08 160.45 39.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.678 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.477 ' HA3' ' O ' ' A' ' 84' ' ' SER . . . 94.39 -16.36 61.24 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.044 -0.823 . . . . 0.0 111.044 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -66.85 -40.53 87.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.836 0.35 . . . . 0.0 110.767 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -54.93 135.37 48.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.574 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 140' ' ' ARG . 7.6 ptmt -159.86 142.34 13.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.851 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.606 ' CD ' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER 167.22 155.96 0.12 Allowed Pre-proline 0 N--CA 1.463 0.195 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.708 179.474 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.606 ' HD2' ' CD ' ' A' ' 140' ' ' ARG . 57.2 Cg_endo -86.0 -8.71 7.78 Favored 'Trans proline' 0 C--N 1.298 -2.101 0 C-N-CA 123.45 2.767 . . . . 0.0 112.206 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.651 HG22 ' N ' ' A' ' 143' ' ' LEU . 1.5 m -45.61 -75.13 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.446 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.651 ' N ' HG22 ' A' ' 142' ' ' THR . 97.3 mt -150.12 151.74 33.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.505 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.455 ' HD2' ' OG ' ' A' ' 149' ' ' SER . 0.0 OUTLIER -133.3 77.33 1.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.829 179.887 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -115.51 18.96 15.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.765 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' VAL . . . . . 0.6 ' O ' ' C ' ' A' ' 147' ' ' ARG . 2.1 m -118.33 -165.24 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.739 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.6 ' C ' ' O ' ' A' ' 146' ' ' VAL . 7.3 ptp85 -19.97 128.52 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.347 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.766 HD11 ' HG3' ' A' ' 153' ' ' MET . 20.7 tt -38.85 139.9 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.644 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.646 ' O ' ' CB ' ' A' ' 153' ' ' MET . 43.0 m -76.17 84.07 3.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -44.28 -37.64 3.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.61 -88.24 0.0 OUTLIER 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.261 0.553 . . . . 0.0 110.907 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.13 -25.95 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.759 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.766 ' HG3' HD11 ' A' ' 148' ' ' ILE . 0.0 OUTLIER -52.36 -49.87 63.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.454 179.754 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.824 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.9 mtp -69.74 -31.47 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.479 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -60.23 -41.87 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.313 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ALA . . . . . 0.692 ' HB3' ' CD2' ' A' ' 48' ' ' LEU . . . -65.76 -43.66 88.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.033 0.444 . . . . 0.0 110.966 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.662 ' HB3' HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -63.24 -44.63 94.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.577 -179.433 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 22' ' ' ALA . 83.2 mt -82.65 -6.83 59.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.221 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.589 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 68.31 28.64 73.19 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.921 -0.871 . . . . 0.0 110.921 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 74.19 39.94 0.46 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.779 0.323 . . . . 0.0 110.396 -179.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 15.5 ttt85 -81.37 134.59 35.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.699 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -124.27 131.54 53.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.391 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 22.1 tttt -139.85 128.75 23.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.522 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 101.92 79.15 1.37 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.986 -0.845 . . . . 0.0 110.986 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.49 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 97.9 m-70 56.23 41.0 29.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.74 0.305 . . . . 0.0 110.755 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 0.1 OUTLIER 76.7 -154.03 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.622 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -69.01 171.3 8.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.694 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -120.11 49.14 1.45 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.214 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' HIS . . . . . 0.568 ' O ' ' C ' ' A' ' 170' ' ' HIS . 86.3 t60 -59.31 -45.66 90.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.387 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' HIS . . . . . 0.568 ' C ' ' O ' ' A' ' 169' ' ' HIS . 0.2 OUTLIER . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.579 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.605 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.475 ' SD ' ' HB2' ' A' ' 66' ' ' GLU . 3.6 mtp . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.65 106.57 0.36 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.478 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 98.3 m-20 -61.23 -38.52 86.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.966 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.634 HG23 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -55.63 -45.83 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 121.37 0.605 . . . . 0.0 109.476 179.655 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.642 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 21.0 m-30 -71.88 -30.25 65.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.577 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.2 mmpt? -57.56 -46.11 84.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.553 0.692 . . . . 0.0 109.194 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.484 ' O ' ' HG3' ' A' ' 11' ' ' GLN . . . -63.87 -35.28 80.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.157 177.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.37 -40.95 79.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.663 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.744 HG22 HD12 ' A' ' 78' ' ' LEU . 75.7 t -62.9 -46.28 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -73.6 -20.42 60.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.038 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 7' ' ' ALA . 2.8 mt-30 -71.06 -36.25 72.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.86 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.721 HD13 ' CD1' ' A' ' 20' ' ' PHE . 31.3 mt -56.41 128.01 33.86 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.949 HG23 ' H ' ' A' ' 16' ' ' GLN . 7.5 t -60.67 167.7 2.58 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.959 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -55.42 -39.75 70.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.835 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -74.18 -46.84 39.57 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.745 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.949 ' H ' HG23 ' A' ' 13' ' ' THR . 65.5 tt0 -62.68 -43.97 97.45 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.964 0.411 . . . . 0.0 110.588 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 30.8 ttmt -65.61 -35.55 81.14 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -60.51 -43.71 96.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.853 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.496 ' HG2' HD11 ' A' ' 158' ' ' LEU . 8.7 tt0 -62.66 -46.5 87.91 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.721 ' CD1' HD13 ' A' ' 12' ' ' LEU . 23.5 m-85 -65.07 -39.45 93.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.876 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -59.36 -39.94 84.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.747 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 1.015 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.03 -41.27 91.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.71 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.859 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -60.69 -39.73 89.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.999 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.661 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 29.8 t80 -57.8 -48.91 78.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.846 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 29' ' ' LEU . 47.8 t0 -63.01 -39.23 94.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 1.015 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.8 OUTLIER -57.37 -44.28 83.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.748 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.935 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 14.4 m-85 -61.85 -42.13 98.67 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.056 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.788 HG11 ' O ' ' A' ' 34' ' ' GLY . 6.6 m -101.29 25.14 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.746 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB3' ' HZ1' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -56.28 107.59 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.262 -179.642 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.63 6.15 80.73 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.454 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -64.52 139.42 58.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.547 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -64.24 -41.88 96.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.991 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.51 -22.35 17.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.643 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.788 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 88.02 -8.52 77.9 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.65 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 92.1 p -83.44 136.99 34.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.342 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.639 ' HB ' HG13 ' A' ' 72' ' ' VAL . 97.5 mt -73.45 106.71 3.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.172 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.599 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 32.5 p -102.17 -175.1 2.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.152 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.915 HG23 HD12 ' A' ' 61' ' ' ILE . 6.4 p -64.19 -30.32 71.39 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.442 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.6 mmtt -72.58 -50.53 24.84 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.192 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.599 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 20.4 mp0 -69.68 -40.71 76.22 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.296 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.955 HD22 HD22 ' A' ' 57' ' ' LEU . 8.2 tt -62.32 -51.4 67.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.434 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.479 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.85 -30.34 77.72 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.489 ' HZ1' ' HB3' ' A' ' 29' ' ' LEU . 0.0 OUTLIER -54.56 -49.86 69.32 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.768 0.318 . . . . 0.0 110.262 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 1.056 HG22 ' SD ' ' A' ' 47' ' ' MET . 1.3 t -72.94 -30.41 32.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.808 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.1 mmm -59.31 -45.08 92.27 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.609 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 73.4 mtp85 -67.25 -37.49 83.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . 1.056 ' SD ' HG22 ' A' ' 44' ' ' VAL . 1.5 ptm -52.9 -30.23 33.02 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.499 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.617 HD13 ' HA ' ' A' ' 153' ' ' MET . 16.6 mt -93.31 -5.46 49.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.776 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 105.57 7.42 36.89 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.609 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 58.9 mm-40 -85.44 138.86 31.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.777 0.322 . . . . 0.0 111.038 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 30.1 t-20 -126.36 59.14 29.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.376 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.589 ' HG2' HD11 ' A' ' 57' ' ' LEU . 73.4 Cg_endo -80.19 142.04 14.94 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 C-N-CA 122.718 2.279 . . . . 0.0 112.864 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.566 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 63.6 p -81.16 160.5 65.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.376 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -56.86 -36.82 99.07 Favored 'Trans proline' 0 C--N 1.295 -2.271 0 C-N-CA 122.747 2.298 . . . . 0.0 111.761 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -62.18 -49.47 75.66 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.978 0.418 . . . . 0.0 110.763 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.574 ' OE2' ' HB2' ' A' ' 52' ' ' PRO . 1.3 pp20? -72.56 -34.99 67.88 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.955 HD22 HD22 ' A' ' 41' ' ' LEU . 38.2 mt -65.16 -41.7 94.43 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.584 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.466 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 29.0 tt0 -61.93 -42.22 98.84 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.18 -179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -62.55 -51.8 65.95 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.426 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.792 ' CE ' HD21 ' A' ' 41' ' ' LEU . 2.5 ppp? -58.49 -34.65 71.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.035 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.915 HD12 HG23 ' A' ' 38' ' ' THR . 15.5 mt -60.92 -44.57 98.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.082 0.468 . . . . 0.0 110.807 177.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.634 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 34.1 t70 -61.0 -27.43 68.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.854 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HB3' 'CL1 ' ' A' ' 201' ' ' V8Y . 2.1 tp10 -49.4 -38.44 28.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.62 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -111.95 -3.78 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.732 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.634 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 51.4 t0 -79.65 104.78 10.48 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.195 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.475 ' HB2' ' SD ' ' A' ' 1' ' ' MET . 64.4 tt0 -63.62 -45.59 89.61 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.418 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.573 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 54.6 p30 -91.38 -0.19 57.61 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.839 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.539 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 60.42 29.75 69.92 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.608 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 3.0 p -69.79 -0.02 6.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.839 0.352 . . . . 0.0 110.763 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.564 ' N ' ' OD2' ' A' ' 65' ' ' ASP . . . 76.77 14.23 82.76 Favored Glycine 0 CA--C 1.521 0.409 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.65 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.0 p -139.74 132.51 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -101.64 110.0 27.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.002 179.173 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.451 ' CG ' ' OE1' ' A' ' 76' ' ' GLU . 55.2 p-10 -78.98 -169.05 1.65 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.227 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.881 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.1 t80 -55.64 -50.09 71.13 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.452 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.543 ' O ' HG23 ' A' ' 79' ' ' VAL . 98.2 m-20 -62.43 -42.77 99.7 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.118 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' A' ' 65' ' ' ASP . 25.7 mt-10 -64.81 -42.07 95.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.381 0.61 . . . . 0.0 110.354 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.683 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -69.62 -44.9 69.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.916 179.532 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.881 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -57.05 -37.21 71.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.757 ' O ' HG13 ' A' ' 82' ' ' VAL . 42.1 t -60.97 -43.25 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.207 178.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.428 ' HB2' HG11 ' A' ' 64' ' ' VAL . 1.6 ttm -54.48 -42.76 71.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.536 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.539 ' O ' ' HG3' ' A' ' 85' ' ' MET . 14.4 mmt -59.85 -45.45 92.39 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.49 . . . . 0.0 110.282 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 79' ' ' VAL . 0.6 OUTLIER -72.23 -31.87 40.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.434 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.642 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 59.8 mtt-85 -60.95 -43.67 98.37 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.321 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.585 ' O ' ' N ' ' A' ' 88' ' ' ASP . 95.0 p -70.63 -35.4 72.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.261 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.749 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 52.6 mtm -61.89 -40.92 97.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.727 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.7 tptp -68.86 -42.11 77.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 110.649 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -99.68 13.4 33.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.631 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.585 ' N ' ' O ' ' A' ' 84' ' ' SER . 16.3 t0 -56.48 -49.52 74.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.029 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.5 t -141.19 132.39 26.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.783 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -61.37 -45.11 95.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.501 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -124.11 -103.02 1.53 Allowed Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -120.16 -62.15 1.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.845 0.355 . . . . 0.0 110.666 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.586 ' O ' ' N ' ' A' ' 140' ' ' ARG . 15.3 m-85 -149.76 -93.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.659 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.496 ' C ' ' O ' ' A' ' 138' ' ' PHE . 1.5 mtpt 31.3 -89.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.817 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.586 ' N ' ' O ' ' A' ' 138' ' ' PHE . 19.5 mmt180 -118.89 165.25 17.4 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.205 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.567 ' HD2' ' HB3' ' A' ' 140' ' ' ARG . 56.3 Cg_endo -83.01 164.83 15.31 Favored 'Trans proline' 0 C--N 1.298 -2.08 0 C-N-CA 123.62 2.88 . . . . 0.0 112.375 -178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.594 HG22 ' N ' ' A' ' 143' ' ' LEU . 88.7 m -63.75 -97.89 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.966 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.594 ' N ' HG22 ' A' ' 142' ' ' THR . 0.5 OUTLIER -126.12 -81.52 0.62 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.713 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 144' ' ' ARG . 31.5 mtp-105 -109.71 129.38 55.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.254 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.806 ' C ' HG23 ' A' ' 146' ' ' VAL . 54.6 mtm180 -114.62 -157.67 0.64 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.347 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' VAL . . . . . 0.806 HG23 ' C ' ' A' ' 145' ' ' ARG . 1.3 t 77.64 44.7 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.439 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.607 ' O ' ' C ' ' A' ' 148' ' ' ILE . 0.2 OUTLIER -96.47 86.78 4.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.542 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.862 ' O ' HG23 ' A' ' 148' ' ' ILE . 11.1 tt 16.38 73.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.8 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.564 ' C ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -26.88 111.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.635 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.508 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.67 -39.49 88.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.483 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -44.69 -80.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.132 0.492 . . . . 0.0 110.457 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.81 -35.81 77.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.773 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.705 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 13.6 ttt -49.94 -51.84 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.885 0.374 . . . . 0.0 110.291 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.859 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 16.1 mtp -69.43 -32.04 70.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.472 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.554 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.6 mt-30 -59.9 -42.06 93.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.103 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ALA . . . . . 0.495 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.52 -42.88 98.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.388 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.758 HD22 HG21 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -66.65 -38.04 86.05 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.55 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.496 HD11 ' HG2' ' A' ' 19' ' ' GLU . 86.9 mt -82.91 -7.52 59.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.383 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 66.46 29.97 75.73 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 66.35 35.46 5.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.77 0.319 . . . . 0.0 110.613 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 161' ' ' ARG . 0.0 OUTLIER -65.33 98.89 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.297 179.737 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -136.34 177.11 8.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.655 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' LYS . . . . . 0.502 ' O ' ' HB3' ' A' ' 167' ' ' HIS . 2.1 mptm? -115.8 107.48 15.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.627 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -91.16 -170.34 42.63 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.42 103.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.798 0.332 . . . . 0.0 110.329 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 63.4 m170 61.32 34.04 18.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.649 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' HIS . . . . . 0.502 ' HB3' ' O ' ' A' ' 163' ' ' LYS . 26.6 p80 -76.76 168.96 19.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.725 179.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 32.5 p80 -155.69 161.43 40.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.488 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -160.42 167.78 26.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.654 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 10.4 p80 . . . . . 0 C--O 1.221 -0.402 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.665 179.959 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.403 'CL1 ' ' HB3' ' A' ' 63' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.539 ' HB2' ' OE1' ' A' ' 66' ' ' GLU . 27.3 ttt . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.576 ' OD2' ' CE1' ' A' ' 5' ' ' TYR . 0.5 OUTLIER -43.36 99.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.475 -179.859 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.403 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 79.2 m-20 -61.57 -40.72 95.77 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.623 ' C ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -56.0 -46.71 80.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.362 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.65 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.1 m-30 -68.65 -33.68 74.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.562 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -56.89 -46.86 81.63 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -62.55 -35.71 80.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -55.66 -40.95 72.96 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.251 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.786 HG22 HD12 ' A' ' 78' ' ' LEU . 68.8 t -63.14 -46.95 94.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.91 -23.3 61.45 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.543 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 84.2 mm-40 -70.43 -35.72 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.658 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.7 ' CD1' HD11 ' A' ' 78' ' ' LEU . 21.9 mt -57.76 126.09 25.85 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.641 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.876 HG23 ' H ' ' A' ' 16' ' ' GLN . 1.5 t -64.12 175.19 1.31 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.284 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.0 mm-40 -60.88 -43.06 98.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.59 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -71.55 -48.14 50.5 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.876 ' H ' HG23 ' A' ' 13' ' ' THR . 61.0 tt0 -61.18 -43.86 98.21 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.295 0.569 . . . . 0.0 110.393 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -68.26 -32.23 72.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.63 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.2 t-20 -60.87 -44.24 97.33 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.884 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -60.71 -44.37 96.68 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.129 0.49 . . . . 0.0 109.835 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.653 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 30.6 m-85 -66.76 -38.04 85.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.847 179.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -60.25 -40.11 89.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.074 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.915 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -59.79 -42.02 92.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.741 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.66 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -62.21 -40.29 95.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.582 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 16.8 t80 -57.64 -49.17 77.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.787 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 29' ' ' LEU . 36.1 t70 -63.49 -40.16 96.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.606 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.97 HD13 ' CB ' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -57.81 -44.02 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.584 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.779 ' CE1' HG11 ' A' ' 44' ' ' VAL . 17.4 m-85 -61.71 -43.12 99.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.738 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.666 HG21 ' O ' ' A' ' 34' ' ' GLY . 28.0 m -102.9 26.96 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.621 ' HB3' ' HZ1' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -57.49 105.67 0.26 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.376 -179.722 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 3.4 67.82 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.485 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -63.44 136.44 57.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.289 . . . . 0.0 110.368 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -61.81 -44.79 96.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.544 ' O ' ' OD1' ' A' ' 33' ' ' ASP . 64.6 t0 -92.43 -22.37 19.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.666 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 88.51 -8.04 80.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.547 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 59.5 p -81.15 137.52 35.93 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.631 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.657 ' CG1' HG13 ' A' ' 28' ' ' VAL . 96.6 mt -74.19 105.8 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.056 0.455 . . . . 0.0 110.974 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.682 ' CB ' HG22 ' A' ' 71' ' ' THR . 4.8 p -102.45 -172.49 2.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.693 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.608 ' O ' HD13 ' A' ' 57' ' ' LEU . 16.3 p -60.88 -37.18 81.27 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.437 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -69.93 -49.18 54.53 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.337 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.583 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 46.9 mp0 -64.35 -42.9 96.0 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.846 HD23 HD22 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -64.06 -48.54 75.83 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.89 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.2 -37.55 94.71 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.581 -1.008 . . . . 0.0 110.581 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.621 ' HZ1' ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -50.37 -63.45 1.12 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 109.851 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.904 HG22 ' HE2' ' A' ' 47' ' ' MET . 13.2 t -59.45 -36.29 63.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.662 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 77.8 mmm -55.35 -39.5 70.12 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.667 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 10.4 mtm105 -66.68 -32.85 74.42 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.904 ' HE2' HG22 ' A' ' 44' ' ' VAL . 32.6 mtm -59.18 -37.43 77.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.783 ' N ' HD22 ' A' ' 48' ' ' LEU . 2.3 mm? -83.76 -5.33 59.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.623 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.37 11.22 34.14 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.667 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -91.25 138.74 31.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.154 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.452 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 34.6 p30 -127.24 57.75 25.75 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.892 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.514 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 68.9 Cg_endo -78.47 150.4 25.02 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.711 2.274 . . . . 0.0 112.56 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.7 p -89.96 156.51 46.78 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.597 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.504 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 52.3 Cg_exo -55.6 -40.26 86.35 Favored 'Trans proline' 0 C--N 1.301 -1.935 0 C-N-CA 122.762 2.308 . . . . 0.0 111.909 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -61.3 -49.65 76.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.497 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.458 ' O ' ' SD ' ' A' ' 60' ' ' MET . 78.7 mm-40 -69.37 -38.99 78.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.18 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.846 HD22 HD23 ' A' ' 41' ' ' LEU . 26.3 mt -60.25 -28.43 68.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.698 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -58.87 -40.02 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.126 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -63.49 -47.85 80.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.631 0.729 . . . . 0.0 110.779 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.547 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.17 -38.9 90.85 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.914 179.698 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.777 HG21 ' O ' ' A' ' 70' ' ' GLY . 17.3 mm -62.36 -45.56 98.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.362 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.638 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.0 t70 -64.26 -23.14 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.807 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.531 ' O ' ' NH1' ' A' ' 83' ' ' ARG . 42.6 tp10 -53.66 -41.08 66.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.572 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.596 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 0.9 OUTLIER -114.68 -3.52 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.4 . . . . 0.0 110.718 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.638 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 63.5 t0 -88.16 88.67 7.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.539 ' OE1' ' HB2' ' A' ' 1' ' ' MET . 77.9 tt0 -71.88 -26.74 62.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.924 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.56 -11.46 60.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.967 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.04 21.73 64.06 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.019 -0.833 . . . . 0.0 111.019 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 p -85.93 0.7 52.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.887 0.375 . . . . 0.0 110.747 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.777 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 72.69 15.51 77.84 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.682 HG22 ' CB ' ' A' ' 37' ' ' SER . 9.8 p -139.43 126.9 21.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.903 0.382 . . . . 0.0 110.657 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.691 HG22 ' O ' ' A' ' 72' ' ' VAL . 0.2 OUTLIER -91.37 107.72 19.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.348 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.463 ' OD1' ' CG ' ' A' ' 76' ' ' GLU . 52.3 p-10 -74.34 -169.08 0.75 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.508 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 1.027 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.8 t80 -57.41 -50.69 72.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 -179.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -62.93 -41.92 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.816 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.614 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 30.8 mt-10 -64.87 -43.26 93.52 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.189 0.519 . . . . 0.0 110.381 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.707 ' HA ' ' HE3' ' A' ' 80' ' ' MET . 0.0 OUTLIER -68.88 -39.76 79.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.443 0.639 . . . . 0.0 109.724 179.739 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.027 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -60.38 -37.03 79.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.431 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.621 ' O ' HG13 ' A' ' 82' ' ' VAL . 28.3 t -61.88 -42.28 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.967 178.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.707 ' HE3' ' HA ' ' A' ' 77' ' ' PHE . 2.6 ptp -56.48 -38.54 71.87 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.878 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.577 ' O ' ' HG3' ' A' ' 85' ' ' MET . 21.1 mmt -62.42 -47.76 82.67 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.978 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 0.1 OUTLIER -72.39 -33.01 44.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.292 179.179 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.629 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 72.5 mtt180 -60.57 -43.82 96.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.248 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 72.4 m -69.94 -38.24 76.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.331 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.978 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 67.2 mtm -61.38 -40.78 95.59 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.655 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.554 ' O ' ' OD2' ' A' ' 87' ' ' ASP . 5.0 mmtt -78.82 -29.37 44.71 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.48 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.554 ' OD2' ' O ' ' A' ' 86' ' ' LYS . 0.0 OUTLIER 60.31 -170.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.492 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.438 ' O ' ' C ' ' A' ' 89' ' ' SER . 54.9 p-10 -82.41 -3.42 55.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.613 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 88' ' ' ASP . 82.7 p -37.12 130.64 0.84 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.471 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -154.77 92.85 1.5 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.51 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.44 -133.02 11.41 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.51 -89.36 0.28 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 0.0 110.664 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -112.0 123.29 49.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.712 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 2.7 mtpt -106.21 -177.5 3.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.6 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.571 ' HB2' ' CD ' ' A' ' 141' ' ' PRO . 8.9 ptp180 -110.95 179.88 0.74 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.301 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.571 ' CD ' ' HB2' ' A' ' 140' ' ' ARG . 29.2 Cg_exo -60.51 102.55 0.19 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.856 2.371 . . . . 0.0 111.864 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.706 HG22 ' HG ' ' A' ' 143' ' ' LEU . 85.4 m -169.96 126.45 0.84 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.76 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.706 ' HG ' HG22 ' A' ' 142' ' ' THR . 68.3 mt 67.02 66.59 0.42 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.832 0.348 . . . . 0.0 110.829 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.498 ' O ' ' NH1' ' A' ' 147' ' ' ARG . 77.7 mtt-85 -66.25 148.54 51.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.78 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.537 ' C ' HG23 ' A' ' 146' ' ' VAL . 11.7 mtm-85 -68.31 -94.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.68 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' VAL . . . . . 0.537 HG23 ' C ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER 43.59 32.48 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.469 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.498 ' NH1' ' O ' ' A' ' 144' ' ' ARG . 0.8 OUTLIER -87.4 169.75 11.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.463 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.464 ' O ' HG23 ' A' ' 148' ' ' ILE . 5.4 tp -34.98 124.95 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.465 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.61 ' O ' ' CB ' ' A' ' 153' ' ' MET . 29.6 m -71.87 88.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.986 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.585 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.62 -31.95 69.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.834 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -53.02 -48.69 67.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.038 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.405 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -107.56 -18.98 13.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.954 0.407 . . . . 0.0 111.064 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.726 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -57.12 -45.98 83.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.226 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.66 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 mtp -70.01 -29.82 66.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.577 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.405 ' OE1' ' HA ' ' A' ' 152' ' ' ALA . 82.3 mt-30 -62.05 -39.61 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.449 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' A' ' 48' ' ' LEU . . . -62.27 -25.27 67.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.781 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.97 ' CB ' HD13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -97.13 -51.97 4.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.756 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 94.6 mt -69.51 -38.14 77.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.543 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 90.3 42.73 5.15 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 69.04 40.07 1.65 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.786 0.327 . . . . 0.0 110.632 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.487 ' HB2' ' HB3' ' A' ' 158' ' ' LEU . 69.0 mtp85 -105.34 -11.1 16.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.543 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -133.19 45.0 2.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.48 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -46.74 128.51 10.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.322 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -96.67 106.18 3.32 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.899 -0.881 . . . . 0.0 110.899 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 37.7 m170 -64.52 -40.16 95.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.59 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -71.82 125.69 27.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.572 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -147.69 71.75 1.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.282 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.466 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 53.5 t-80 60.19 38.88 19.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.661 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -116.53 127.76 54.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.698 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.498 179.923 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.596 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.548 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 96.1 mtp . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -60.95 126.6 27.96 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.48 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.444 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 71.4 m-20 -68.82 -39.5 80.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.573 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.889 HD11 ' HE3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -54.7 -47.89 72.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.649 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.663 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 20.9 m-30 -69.2 -31.89 70.8 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.551 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.76 -45.37 89.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.05 -34.15 76.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.511 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -58.39 -42.01 86.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.758 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.838 HG22 HD12 ' A' ' 78' ' ' LEU . 95.4 t -63.71 -43.95 98.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -68.58 -24.3 64.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.522 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -71.15 -35.4 71.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.691 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.832 HD13 ' CD1' ' A' ' 20' ' ' PHE . 17.2 mt -64.5 107.8 1.48 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.277 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.706 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -51.21 -179.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.649 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.553 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 76.5 mm-40 -60.92 -44.77 96.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.981 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -70.92 -45.7 63.8 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.95 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.706 ' H ' HG23 ' A' ' 13' ' ' THR . 6.6 tt0 -63.66 -44.34 94.08 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.178 0.514 . . . . 0.0 110.127 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.586 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.6 ttmt -70.44 -30.83 67.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.589 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.553 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 63.0 t30 -60.33 -44.46 95.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.106 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.41 -45.44 93.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.106 0.479 . . . . 0.0 109.947 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.832 ' CD1' HD13 ' A' ' 12' ' ' LEU . 28.4 m-85 -65.11 -39.01 92.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.198 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -60.53 -39.51 88.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.836 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.895 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.53 -42.22 96.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.852 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.753 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.66 -39.41 91.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.181 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.707 ' O ' HG22 ' A' ' 28' ' ' VAL . 17.2 t80 -57.27 -48.63 78.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.638 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.587 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.75 -39.55 94.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.527 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.895 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -56.65 -45.88 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.528 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.709 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 22.6 m-85 -62.03 -41.99 98.69 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.365 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.707 HG22 ' O ' ' A' ' 24' ' ' PHE . 15.7 m -101.57 21.36 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.427 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -53.12 112.47 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.325 -179.825 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.32 -9.07 78.35 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.595 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -63.15 127.03 29.38 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.247 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.11 -41.39 97.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.56 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.5 p30 -81.36 -22.38 38.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.874 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.56 ' N ' ' OD1' ' A' ' 33' ' ' ASP . . . 78.73 -2.5 68.01 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.58 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 57.6 p -90.6 136.93 32.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.878 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -73.6 106.22 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.662 -0.415 . . . . 0.0 111.358 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.585 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 56.1 p -101.94 161.65 13.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.798 179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.86 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -41.66 -35.58 0.79 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.611 -179.339 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -49.54 57.31 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.585 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 3.4 mp0 -67.18 -40.06 86.51 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.877 ' CD2' HD22 ' A' ' 57' ' ' LEU . 6.6 tt -60.06 -50.44 73.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.44 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.458 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.93 -35.74 92.26 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.5 -60.98 2.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.22 0.534 . . . . 0.0 109.947 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.85 HG22 ' HE2' ' A' ' 47' ' ' MET . 25.5 t -61.06 -38.93 80.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 177.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.636 ' HB3' ' HB2' ' A' ' 50' ' ' GLN . 88.8 mmm -54.46 -41.6 69.67 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 71.6 mtp180 -65.01 -32.65 74.49 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.85 ' HE2' HG22 ' A' ' 44' ' ' VAL . 33.1 mtm -58.7 -37.3 75.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.828 ' N ' HD22 ' A' ' 48' ' ' LEU . 2.1 mm? -85.76 0.01 54.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.516 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.36 5.45 57.01 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.645 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 5.8 mm-40 -80.53 138.49 36.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.961 0.41 . . . . 0.0 110.955 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.463 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 26.6 p-10 -128.54 56.79 24.28 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.309 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.7 ' CG ' HD21 ' A' ' 57' ' ' LEU . 64.0 Cg_endo -77.67 139.86 18.27 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.721 2.281 . . . . 0.0 112.864 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.6 p -78.6 158.16 76.29 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.47 -35.21 84.57 Favored 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.726 2.284 . . . . 0.0 111.824 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -61.02 -51.6 68.53 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.21 0.529 . . . . 0.0 110.387 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.579 ' O ' ' CE ' ' A' ' 60' ' ' MET . 72.9 mt-10 -69.64 -39.89 76.84 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.327 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.877 HD22 ' CD2' ' A' ' 41' ' ' LEU . 43.4 mt -61.48 -37.75 84.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.678 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.527 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 50.6 tt0 -59.8 -41.36 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.733 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -62.85 -41.86 99.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.255 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.579 ' CE ' ' O ' ' A' ' 56' ' ' GLU . 4.4 mmt -62.57 -39.09 92.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.86 HD11 ' N ' ' A' ' 38' ' ' THR . 2.8 mt -61.65 -45.7 98.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.489 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 14.9 t70 -60.14 -36.08 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.565 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -45.98 -38.91 8.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.157 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.563 ' CG1' ' HD3' ' A' ' 83' ' ' ARG . 0.6 OUTLIER -113.88 -10.11 12.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.489 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 16.0 t70 -96.65 67.37 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.323 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.548 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 51.0 mt-10 -67.71 -17.62 64.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.793 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.466 ' OD1' ' OD2' ' A' ' 65' ' ' ASP . 49.6 p-10 -75.93 -10.3 59.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.496 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.68 14.45 75.26 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.451 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 88.1 p -71.86 -16.84 62.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.617 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.46 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 72.97 17.04 78.34 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.583 ' CG2' ' HB3' ' A' ' 37' ' ' SER . 0.2 OUTLIER -149.2 119.43 7.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.924 0.392 . . . . 0.0 110.76 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.878 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.1 OUTLIER -85.99 110.38 19.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.44 179.846 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.543 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -81.49 -162.29 0.5 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.886 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.9 t80 -56.72 -49.52 74.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.775 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.468 ' O ' HG23 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -65.6 -44.96 85.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.644 179.526 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.62 ' C ' HG23 ' A' ' 72' ' ' VAL . 53.2 mt-10 -62.69 -41.37 99.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.321 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.759 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -71.04 -44.34 66.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.186 0.517 . . . . 0.0 109.634 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.886 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.1 -37.33 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.619 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.605 HG12 ' CD ' ' A' ' 83' ' ' ARG . 42.6 t -63.84 -41.73 93.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.037 178.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.735 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -54.25 -38.34 65.68 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.204 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.735 ' N ' ' HG2' ' A' ' 80' ' ' MET . 12.7 mmt -65.36 -48.25 73.61 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 121.255 0.55 . . . . 0.0 110.848 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.97 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 0.1 OUTLIER -72.78 -28.75 27.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.613 179.543 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.663 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 65.0 mtp85 -59.18 -48.06 83.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.634 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 84.8 p -70.48 -37.0 74.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.668 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.97 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 67.9 mtm -60.83 -48.03 83.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.385 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.889 ' HE3' HD11 ' A' ' 4' ' ' ILE . 57.2 mmtt -66.81 -40.45 88.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.893 0.378 . . . . 0.0 110.9 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -69.95 -39.6 75.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.796 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -61.59 -44.71 96.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.988 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.57 ' O ' ' O ' ' A' ' 86' ' ' LYS . 41.9 t -135.98 165.81 24.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.746 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.538 ' O ' ' HD3' ' A' ' 90' ' ' LYS . 11.1 tmtt? 66.91 132.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.134 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -153.35 -109.46 0.38 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.614 ' O ' ' CB ' ' A' ' 138' ' ' PHE . 17.8 mtmt -105.08 15.46 27.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.468 0.175 . . . . 0.0 110.774 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.614 ' CB ' ' O ' ' A' ' 137' ' ' LYS . 31.4 t80 91.56 -15.9 0.18 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.539 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.538 ' CG ' ' N ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -92.8 -77.35 0.44 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.446 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.538 ' N ' ' CG ' ' A' ' 139' ' ' LYS . 49.5 mtt180 -136.69 165.55 34.34 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.684 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.525 ' HD2' ' HB3' ' A' ' 140' ' ' ARG . 51.3 Cg_endo -84.85 -11.2 7.92 Favored 'Trans proline' 0 C--N 1.302 -1.908 0 C-N-CA 123.146 2.564 . . . . 0.0 112.439 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.9 m 71.93 -75.9 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.512 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 90.4 mt -119.24 143.19 47.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.613 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.404 ' H ' ' HG2' ' A' ' 144' ' ' ARG . 0.0 OUTLIER -116.18 34.8 4.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.508 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.626 ' C ' ' HD2' ' A' ' 147' ' ' ARG . 99.9 mtt180 -59.93 108.3 0.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.459 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' VAL . . . . . 0.51 ' C ' ' HD3' ' A' ' 147' ' ' ARG . 10.1 m -83.71 -25.76 7.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.391 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.626 ' HD2' ' C ' ' A' ' 145' ' ' ARG . 0.0 OUTLIER 53.17 -150.57 0.36 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.681 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.546 ' O ' HG23 ' A' ' 148' ' ' ILE . 12.6 tt -38.06 124.79 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.485 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.576 ' O ' ' CB ' ' A' ' 153' ' ' MET . 3.4 m -70.19 103.73 2.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.387 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.499 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.85 -38.81 83.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.341 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.613 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -45.02 -82.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.435 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -60.41 -35.2 75.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.805 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.601 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 9.5 ttt -49.74 -52.41 31.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.245 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.753 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.7 mtp -71.1 -29.21 64.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.481 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 52.7 mt-30 -60.3 -44.09 95.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.345 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.81 98.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.077 0.465 . . . . 0.0 110.17 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -64.37 -42.13 96.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.642 -179.533 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.448 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 85.4 mt -88.21 -2.88 58.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.405 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.512 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 49.41 35.96 22.4 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 69.13 45.93 0.85 Allowed 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.593 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.448 ' HB2' ' HB3' ' A' ' 158' ' ' LEU . 4.3 mtp180 -45.6 -35.74 4.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.642 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -154.31 167.4 30.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.647 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -144.9 -164.81 2.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.401 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 85.83 11.55 73.56 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.577 ' O ' ' O ' ' A' ' 166' ' ' HIS . 0.1 OUTLIER -102.44 -88.29 0.39 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.813 0.34 . . . . 0.0 110.765 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.577 ' O ' ' O ' ' A' ' 165' ' ' HIS . 98.3 m-70 37.5 -166.4 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.626 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' HIS . . . . . 0.518 ' CD2' ' CD2' ' A' ' 168' ' ' HIS . 1.7 p-80 -94.5 3.21 55.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.79 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.556 ' O ' ' C ' ' A' ' 169' ' ' HIS . 98.9 m-70 -102.15 -15.64 16.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.655 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' HIS . . . . . 0.556 ' C ' ' O ' ' A' ' 168' ' ' HIS . 49.6 t-80 25.43 -109.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.552 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' HIS . . . . . 0.516 ' C ' ' O ' ' A' ' 169' ' ' HIS . 12.2 m-70 . . . . . 0 C--O 1.219 -0.534 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.608 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.432 ' O2 ' HD12 ' A' ' 148' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.599 ' CE ' HG21 ' A' ' 79' ' ' VAL . 8.9 mmm . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.515 ' OD2' ' CE1' ' A' ' 5' ' ' TYR . 1.2 m-20 71.71 105.21 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.746 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 45.9 m-20 -62.06 -44.26 97.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.019 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.61 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -50.81 -46.75 29.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 121.025 0.44 . . . . 0.0 109.982 179.091 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.698 ' CD1' ' HG2' ' A' ' 83' ' ' ARG . 22.2 m-30 -69.95 -34.0 72.85 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.604 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -54.9 -45.61 74.74 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.302 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 11' ' ' GLN . . . -65.1 -33.27 75.63 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.601 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.84 -40.27 83.75 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.877 HG22 HD12 ' A' ' 78' ' ' LEU . 95.1 t -61.98 -46.13 97.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.046 0.45 . . . . 0.0 109.788 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -73.42 -23.78 60.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 7' ' ' ALA . 3.1 mm-40 -72.03 -38.6 69.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.779 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.76 HD12 HD11 ' A' ' 78' ' ' LEU . 21.5 mt -49.4 118.72 2.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.734 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.657 HG22 ' HB2' ' A' ' 16' ' ' GLN . 8.8 t -56.33 -177.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.374 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.548 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 88.0 tt0 -60.04 -44.01 94.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.434 ' H ' HG23 ' A' ' 13' ' ' THR . 86.5 tt0 -74.0 -51.23 16.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.657 ' HB2' HG22 ' A' ' 13' ' ' THR . 13.0 mt-30 -50.47 -52.76 35.23 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.591 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.0 ttmt -66.18 -35.06 79.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.046 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.548 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 62.2 t30 -59.6 -43.77 93.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.199 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.48 ' O ' ' HE3' ' A' ' 154' ' ' MET . 12.6 mt-10 -61.02 -46.92 88.78 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.196 0.522 . . . . 0.0 110.492 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.64 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 67.4 m-85 -66.15 -38.54 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.224 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -56.5 -42.58 78.57 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.993 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.77 -40.86 94.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.915 178.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.866 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.185 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.675 ' O ' HG22 ' A' ' 28' ' ' VAL . 15.9 t80 -57.32 -48.23 79.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.444 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.609 ' O ' ' N ' ' A' ' 29' ' ' LEU . 64.6 t0 -62.23 -40.02 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.393 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.993 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.33 -46.35 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.75 179.674 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.791 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 12.9 m-85 -60.66 -41.32 94.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.459 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.801 HG13 HG12 ' A' ' 36' ' ' ILE . 25.1 m -107.22 25.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.619 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.656 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -56.97 105.93 0.26 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.305 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.49 -9.32 58.94 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.595 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -64.14 129.76 41.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.806 0.336 . . . . 0.0 110.517 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.63 -43.85 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.779 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 50.2 p30 -80.09 -23.36 41.33 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.834 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.6 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 79.68 1.81 87.32 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.649 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 75.4 p -90.98 135.67 33.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.625 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.832 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -77.6 110.46 13.31 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.101 -179.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.587 ' C ' HD11 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -108.86 -178.58 3.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.05 178.918 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.611 ' N ' HD11 ' A' ' 61' ' ' ILE . 2.8 p -58.58 -24.23 60.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.516 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -84.46 -48.37 9.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.229 178.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.677 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 60.3 mp0 -71.96 -20.81 61.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.581 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.975 HD22 HD22 ' A' ' 57' ' ' LEU . 10.0 tt -83.2 -49.28 9.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.951 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.553 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -60.15 -38.08 93.87 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.677 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.41 -58.22 4.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.731 0.3 . . . . 0.0 110.305 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.834 ' CG2' HG22 ' A' ' 26' ' ' ILE . 3.0 t -62.85 -32.09 54.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.595 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 89.6 mmm -60.19 -42.61 95.43 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.716 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 40.1 mtp180 -67.45 -32.04 72.63 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.637 ' HE2' HG22 ' A' ' 44' ' ' VAL . 26.8 mtm -59.53 -36.65 76.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.881 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.581 HD21 ' HB3' ' A' ' 156' ' ' ALA . 73.4 mt -88.59 -0.79 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.314 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.6 4.15 52.54 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.716 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 25.2 mm100 -90.34 135.27 33.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.972 0.415 . . . . 0.0 110.574 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.557 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 34.1 t-20 -134.11 60.99 48.29 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.892 ' HG2' HD21 ' A' ' 57' ' ' LEU . 60.2 Cg_endo -75.46 149.14 34.48 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.684 2.256 . . . . 0.0 112.41 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.623 ' OG1' ' OE1' ' A' ' 56' ' ' GLU . 62.6 p -81.64 161.68 60.65 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.056 0.455 . . . . 0.0 110.623 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 47.1 Cg_exo -54.63 -39.36 89.14 Favored 'Trans proline' 0 C--N 1.303 -1.821 0 C-N-CA 122.71 2.273 . . . . 0.0 111.837 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -62.77 -50.49 70.85 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.154 0.502 . . . . 0.0 110.827 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.623 ' OE1' ' OG1' ' A' ' 53' ' ' THR . 21.9 mp0 -67.94 -39.68 83.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.841 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.975 HD22 HD22 ' A' ' 41' ' ' LEU . 23.0 mt -62.09 -39.37 92.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.754 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -59.43 -40.66 87.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.34 -49.33 76.01 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.026 0.441 . . . . 0.0 111.203 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.814 ' SD ' HD23 ' A' ' 57' ' ' LEU . 2.3 ptp -64.74 -35.16 80.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.489 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.72 HG12 HD13 ' A' ' 41' ' ' LEU . 1.1 mt -62.63 -46.61 95.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.075 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 13.2 t70 -61.45 -30.22 70.44 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.53 ' CG ' ' NH1' ' A' ' 83' ' ' ARG . 5.3 tp10 -47.1 -37.14 9.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.283 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 1.5 m -114.52 -16.3 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.662 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.564 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 38.8 t70 -88.25 78.31 8.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.47 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.563 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 1.1 tt0 -72.77 -11.65 60.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.782 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.53 -12.13 60.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.532 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.29 14.07 68.38 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 85.7 p -85.1 -6.41 59.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 110.713 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.535 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 71.51 17.88 76.66 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.649 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 0.9 OUTLIER -138.45 124.12 19.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.934 0.397 . . . . 0.0 110.76 -179.636 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.832 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -90.12 117.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.421 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.51 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 45.3 p-10 -82.26 -168.12 1.85 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.609 179.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.98 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -56.84 -51.06 70.48 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.714 -179.521 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.67 -42.59 95.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.899 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.604 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 46.4 mt-10 -64.49 -42.05 96.09 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.109 0.48 . . . . 0.0 110.575 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.731 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -70.29 -43.19 70.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.797 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.98 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.92 -37.79 61.15 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.599 HG21 ' CE ' ' A' ' 1' ' ' MET . 39.7 t -61.56 -45.87 97.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.162 0.506 . . . . 0.0 110.42 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.714 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -53.6 -36.88 62.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.305 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.714 ' N ' ' HG2' ' A' ' 80' ' ' MET . 24.7 mmt -66.55 -50.0 64.6 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.198 0.523 . . . . 0.0 110.494 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.668 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER -68.43 -28.07 39.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.306 179.299 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.698 ' HG2' ' CD1' ' A' ' 5' ' ' TYR . 21.0 mtp180 -61.48 -46.41 90.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.505 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.1 m -75.65 -34.65 60.52 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.307 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.614 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 75.8 mtm -63.81 -41.35 97.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.95 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.577 ' O ' ' C ' ' A' ' 87' ' ' ASP . 0.1 OUTLIER -71.38 -42.67 68.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.698 -179.208 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.577 ' C ' ' O ' ' A' ' 86' ' ' LYS . 5.6 p-10 22.18 75.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.412 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.639 ' O ' ' C ' ' A' ' 89' ' ' SER . 99.1 m-20 -61.11 -40.14 92.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.731 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.639 ' C ' ' O ' ' A' ' 88' ' ' ASP . 23.5 m 8.54 -102.07 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 O-C-N 123.461 0.476 . . . . 0.0 110.707 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -129.83 -88.8 0.5 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.653 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 137' ' ' LYS . . . 74.31 -156.89 50.51 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 136' ' ' GLY . 0.0 OUTLIER 81.7 -88.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 110.655 -179.625 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.447 ' H ' ' HB3' ' A' ' 137' ' ' LYS . 77.9 m-85 -98.29 5.07 48.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.834 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.573 ' O ' ' O ' ' A' ' 140' ' ' ARG . 3.2 mmmt -125.34 62.28 1.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.511 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.573 ' O ' ' O ' ' A' ' 139' ' ' LYS . 5.2 ptp85 47.59 171.67 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.144 0.497 . . . . 0.0 110.46 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.708 ' O ' ' CB ' ' A' ' 142' ' ' THR . 23.3 Cg_exo -64.09 -51.36 2.23 Favored 'Trans proline' 0 C--N 1.302 -1.873 0 C-N-CA 122.886 2.39 . . . . 0.0 112.482 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.708 ' CB ' ' O ' ' A' ' 141' ' ' PRO . 2.5 m 137.16 154.26 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 123.782 0.676 . . . . 0.0 110.141 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.677 ' CB ' ' O ' ' A' ' 142' ' ' THR . 86.5 mt 101.11 130.2 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.14 0 O-C-N 123.992 0.807 . . . . 0.0 110.658 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 58.3 ttp85 -161.49 -52.63 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.306 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 13.5 mtp-105 -151.79 21.01 0.7 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.785 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' VAL . . . . . 1.003 HG12 ' HG3' ' A' ' 147' ' ' ARG . 88.4 t -130.76 136.6 57.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.76 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 1.003 ' HG3' HG12 ' A' ' 146' ' ' VAL . 0.0 OUTLIER 70.72 146.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.456 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.574 HD12 ' SD ' ' A' ' 45' ' ' MET . 18.7 tt -53.76 127.84 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.415 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.65 ' O ' ' CB ' ' A' ' 153' ' ' MET . 68.4 m -67.37 92.91 0.3 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.254 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -50.04 -34.09 20.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.514 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.534 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -62.17 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.229 0.537 . . . . 0.0 110.891 179.563 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -60.46 -30.92 69.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.554 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.791 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 ttt -50.96 -54.5 23.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.652 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' MET . . . . . 0.866 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.9 mtp -65.77 -31.84 73.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.193 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.3 mt-30 -60.69 -41.47 95.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.882 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ALA . . . . . 0.581 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.57 -39.89 95.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.095 0.474 . . . . 0.0 110.267 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.688 HD22 HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -71.6 -48.08 50.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.27 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' A' ' 22' ' ' ALA . 91.9 mt -70.62 -40.07 73.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.777 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' GLY . . . . . 0.757 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 83.95 12.83 76.21 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 111.051 -0.819 . . . . 0.0 111.051 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.757 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 89.88 61.05 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.808 0.337 . . . . 0.0 110.631 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ARG . . . . . 0.761 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 34.2 mtp180 -93.17 -171.6 2.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.53 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.761 ' HB3' ' O ' ' A' ' 161' ' ' ARG . . . 90.92 107.85 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.51 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -75.58 136.09 40.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.452 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.17 -166.23 53.68 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 1.5 t60 56.96 87.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.815 0.341 . . . . 0.0 110.62 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 167' ' ' HIS . 92.8 m-70 -61.78 -41.1 97.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.384 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 167' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 166' ' ' HIS . 1.5 t-80 173.58 -155.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.544 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.538 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 52.6 t-80 -101.57 23.14 11.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.552 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -156.9 168.07 28.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.566 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.449 179.814 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' V8Y . . . . . 0.532 ' O2 ' ' SD ' ' A' ' 60' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.577 HD13 ' C ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.644 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.0 m-30 -72.9 -29.33 63.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.606 178.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -59.02 -46.49 88.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.579 -0.896 . . . . 0.0 108.579 179.305 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.92 81.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.455 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.67 -40.88 80.39 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.6 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.035 HG22 HD12 ' A' ' 78' ' ' LEU . 75.4 t -62.48 -47.3 93.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.626 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.64 -24.76 66.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.648 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -70.47 -36.32 73.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.045 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 78' ' ' LEU . 57.6 mt -58.53 127.9 34.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.266 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 1.025 HG23 ' H ' ' A' ' 16' ' ' GLN . 4.4 t -61.87 171.37 1.68 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -60.69 -39.98 90.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.17 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -48.81 45.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 1.025 ' H ' HG23 ' A' ' 13' ' ' THR . 64.5 tt0 -62.61 -42.73 99.75 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.132 0.492 . . . . 0.0 110.585 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 32.3 ttmt -66.81 -35.24 79.61 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.689 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -59.34 -44.07 92.69 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.488 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -61.84 -44.78 96.14 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.402 0.62 . . . . 0.0 109.957 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.673 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 14.1 m-30 -64.45 -38.66 91.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.766 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 24' ' ' PHE . 24.7 tptm -59.09 -39.76 83.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.88 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.798 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -59.65 -42.62 93.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.845 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.54 -38.53 87.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.01 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.639 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 17.3 t80 -56.57 -49.56 74.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.607 ' O ' ' N ' ' A' ' 29' ' ' LEU . 61.6 t0 -62.27 -39.23 92.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.263 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.798 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.5 OUTLIER -56.4 -44.48 80.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.669 179.896 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.652 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 16.8 m-85 -62.17 -42.71 99.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.375 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.687 HG13 ' CG1' ' A' ' 36' ' ' ILE . 6.2 m -97.51 11.37 5.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.741 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.607 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -42.03 108.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.06 12.74 58.57 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.651 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -83.9 128.76 34.77 Favored 'General case' 0 C--N 1.331 -0.239 0 O-C-N 122.777 -0.249 . . . . 0.0 110.555 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -64.18 -40.73 96.72 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.701 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -21.96 25.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.565 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 81.35 -1.23 86.11 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.591 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 55.6 p -86.16 135.46 33.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.687 ' CG1' HG13 ' A' ' 28' ' ' VAL . 89.6 mt -76.87 105.65 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.106 0.479 . . . . 0.0 110.709 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.864 ' HB3' HG22 ' A' ' 71' ' ' THR . 60.3 p -103.33 177.49 4.83 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.701 HG22 ' C ' ' A' ' 57' ' ' LEU . 6.9 p -53.32 -39.59 64.15 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.043 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -66.47 -44.44 82.71 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.634 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 71.1 mm-40 -73.53 -20.69 60.58 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 109.956 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.609 ' O ' ' HG2' ' A' ' 45' ' ' MET . 0.4 OUTLIER -81.82 -47.37 12.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.54 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.504 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -60.94 -37.94 94.63 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.369 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.634 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -48.69 -57.29 6.51 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.203 0.502 . . . . 0.0 110.276 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.757 HG21 HG22 ' A' ' 26' ' ' ILE . 11.8 t -63.67 -35.63 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 CA-C-O 121.097 0.475 . . . . 0.0 110.019 177.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.609 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 87.5 mmm -59.06 -41.58 88.26 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.636 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 76.5 mtp85 -66.42 -33.16 75.08 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.556 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 20.5 mtm -59.75 -38.28 81.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.969 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.624 HD11 ' HG3' ' A' ' 153' ' ' MET . 79.3 mt -84.19 -1.87 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.857 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.41 8.77 52.25 Favored Glycine 0 CA--C 1.529 0.906 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.636 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 87.0 mm-40 -90.83 138.08 31.86 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.855 0.36 . . . . 0.0 111.078 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.466 ' OD1' ' O ' ' A' ' 51' ' ' ASN . 21.0 t-20 -127.38 60.89 46.1 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.81 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.652 ' HG2' HD11 ' A' ' 57' ' ' LEU . 81.7 Cg_endo -79.32 139.89 15.02 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.573 2.182 . . . . 0.0 112.169 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 73.8 p -74.25 152.31 88.09 Favored Pre-proline 0 CA--C 1.516 -0.34 0 CA-C-O 121.037 0.446 . . . . 0.0 110.323 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.13 -43.06 60.0 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 122.722 2.281 . . . . 0.0 112.294 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -62.74 -40.28 96.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.168 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.434 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 0.9 OUTLIER -78.84 -31.89 45.88 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.701 ' C ' HG22 ' A' ' 38' ' ' THR . 3.1 mt -60.96 -26.27 67.42 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.16 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.56 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 37.7 tt0 -58.93 -37.74 77.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.723 -178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -61.58 -41.28 97.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.158 0.504 . . . . 0.0 110.804 178.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.492 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 3.6 mmt -64.51 -42.02 96.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.763 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.562 HG21 ' O ' ' A' ' 70' ' ' GLY . 10.2 mm -61.62 -44.56 98.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.696 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.507 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 66.0 t0 -59.79 -29.91 68.53 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.33 -42.88 10.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.972 0.415 . . . . 0.0 110.338 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -113.2 -12.34 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.267 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.513 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 30.7 t70 -91.98 63.24 4.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.399 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -65.21 -21.0 66.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.821 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.488 ' OD2' ' OG ' ' A' ' 69' ' ' SER . 58.7 p-10 -74.67 -8.48 56.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.896 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.74 15.17 75.69 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.488 ' OG ' ' OD2' ' A' ' 67' ' ' ASP . 66.4 m -66.21 -26.74 67.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.927 0.394 . . . . 0.0 110.405 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.562 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 86.41 -1.14 87.34 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.864 HG22 ' HB3' ' A' ' 37' ' ' SER . 25.6 p -136.44 133.77 36.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.922 0.391 . . . . 0.0 110.926 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.732 HG22 ' O ' ' A' ' 72' ' ' VAL . 0.2 OUTLIER -100.48 103.82 15.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.217 0.532 . . . . 0.0 109.972 179.212 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.538 ' OD1' ' HA ' ' A' ' 35' ' ' SER . 18.1 m-20 -72.27 -163.9 0.13 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.302 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 1.02 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.4 t80 -57.86 -49.88 75.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.004 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.464 ' O ' HG23 ' A' ' 79' ' ' VAL . 97.3 m-20 -62.99 -42.29 99.8 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.017 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.534 ' CD ' ' HA ' ' A' ' 72' ' ' VAL . 45.5 mt-10 -64.38 -42.09 96.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.385 0.612 . . . . 0.0 111.132 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.713 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -71.33 -41.13 70.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.999 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.035 HD12 HG22 ' A' ' 9' ' ' VAL . 0.3 OUTLIER -58.39 -37.22 74.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.846 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 82' ' ' VAL . 42.1 t -60.69 -42.53 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 N-CA-C 109.335 -0.616 . . . . 0.0 109.335 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.454 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 1.0 OUTLIER -53.27 -43.53 67.5 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.916 -0.714 . . . . 0.0 110.083 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 24.7 mmt -60.83 -45.27 95.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.762 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.644 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.437 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.672 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.732 HG23 ' O ' ' A' ' 148' ' ' ILE . 20.8 tt . . . . . 0 C--O 1.231 0.12 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.635 ' O ' ' CB ' ' A' ' 153' ' ' MET . 66.3 m -42.21 96.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 148' ' ' ILE . . . -60.1 -39.1 84.99 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.326 0.391 . . . . 0.0 111.225 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.555 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 40.9 m-20 -50.88 -77.53 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.508 0.67 . . . . 0.0 110.811 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.6 -35.92 81.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.199 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.652 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 9.6 ttt -48.49 -53.78 16.73 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.382 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.845 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 2.0 mtp -65.93 -34.0 77.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.09 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.555 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 75.7 mt-30 -59.28 -43.28 92.53 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.62 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.441 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.32 -43.97 96.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -63.66 -41.02 98.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.482 -179.156 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.566 HD21 ' HB3' ' A' ' 22' ' ' ALA . 92.4 mt . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.545 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.629 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.191 0 CA-C-O 121.293 0.568 . . . . 0.0 109.855 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.649 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 21.6 m-30 -71.01 -29.05 64.89 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.616 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 1.4 mmpt? -58.93 -43.79 91.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.551 0.691 . . . . 0.0 109.282 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.63 -34.17 77.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.157 177.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.95 -41.41 82.77 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.611 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.675 HG13 ' HG ' ' A' ' 78' ' ' LEU . 72.2 t -62.24 -45.76 98.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.119 0.485 . . . . 0.0 109.705 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -70.06 -23.07 63.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.642 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.44 -33.74 67.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.536 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.587 HD12 HD11 ' A' ' 78' ' ' LEU . 13.9 mt -62.46 129.42 40.56 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.334 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.761 HG23 ' H ' ' A' ' 16' ' ' GLN . 2.6 t -69.64 -179.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.193 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 79.0 mm-40 -60.85 -45.03 96.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.138 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.85 -49.63 56.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.952 0.406 . . . . 0.0 111.454 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.761 ' H ' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -57.43 -51.31 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.273 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.65 -35.28 79.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.883 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.552 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.9 t-20 -60.04 -43.36 95.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.111 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.497 ' O ' ' CE ' ' A' ' 154' ' ' MET . 17.0 mt-10 -60.0 -51.06 71.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.353 179.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.667 ' CD2' ' SD ' ' A' ' 154' ' ' MET . 42.2 m-85 -62.69 -36.2 82.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.751 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.62 -41.3 85.6 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.767 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.67 -42.29 96.78 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.845 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.702 ' HB1' HD12 ' A' ' 157' ' ' LEU . . . -61.76 -39.14 90.58 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.041 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.762 ' O ' HG22 ' A' ' 28' ' ' VAL . 10.0 t80 -55.9 -49.75 72.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.391 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.419 ' O ' ' N ' ' A' ' 29' ' ' LEU . 38.7 t70 -62.45 -41.42 98.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.603 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.767 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -59.96 -42.45 89.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.291 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 1.102 ' CE1' HD11 ' A' ' 157' ' ' LEU . 5.6 m-85 -61.08 -39.42 89.85 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.33 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.762 HG22 ' O ' ' A' ' 24' ' ' PHE . 6.8 m -105.18 24.6 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.597 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -54.72 105.85 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.151 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.03 3.16 59.13 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.549 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -69.37 134.48 49.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 110.46 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -67.84 -42.03 82.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.526 ' O ' ' OD1' ' A' ' 33' ' ' ASP . 67.5 t0 -92.13 -20.83 20.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.389 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.703 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 88.48 -8.3 79.34 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.586 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.8 p -78.13 137.08 38.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.359 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.764 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.9 mt -75.82 107.86 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.893 0.378 . . . . 0.0 111.189 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.616 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 24.3 p -101.28 175.19 5.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.828 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.708 ' N ' HD11 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -55.66 -35.79 66.35 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.363 -179.393 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -71.86 -46.28 58.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.244 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.652 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . 33.1 mp0 -72.42 -20.93 61.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.826 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 45' ' ' MET . 1.1 tt -82.49 -48.97 10.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.932 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.541 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.57 -37.4 94.67 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.652 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.17 -57.53 4.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.376 -0.485 . . . . 0.0 110.121 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.718 HG11 ' CE1' ' A' ' 27' ' ' PHE . 11.3 t -62.68 -34.35 64.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.051 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 1.007 ' SD ' HD12 ' A' ' 148' ' ' ILE . 91.3 mmm -58.59 -42.34 87.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 34.9 mtp-105 -66.57 -33.28 75.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 109.776 177.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.492 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 16.4 mtm -59.74 -37.08 77.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.865 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.819 HD21 ' HB3' ' A' ' 156' ' ' ALA . 69.7 mt -87.06 0.05 55.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.63 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.75 7.69 52.93 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.179 -0.769 . . . . 0.0 111.179 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.666 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 23.1 mm100 -96.06 131.94 41.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 110.831 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.464 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 40.2 t-20 -127.87 60.6 46.64 Favored Pre-proline 0 C--N 1.324 -0.542 0 C-N-CA 120.109 -0.636 . . . . 0.0 110.943 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.761 ' HG2' HD21 ' A' ' 57' ' ' LEU . 59.7 Cg_endo -76.72 138.35 18.93 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 C-N-CA 122.615 2.21 . . . . 0.0 112.355 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.1 p -72.06 154.06 92.5 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.0 110.502 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.98 -35.65 90.43 Favored 'Trans proline' 0 C--N 1.3 -1.996 0 C-N-CA 122.836 2.357 . . . . 0.0 111.705 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.88 -41.18 97.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.329 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.417 ' HB3' ' HE1' ' A' ' 60' ' ' MET . 2.8 mt-10 -81.26 -37.25 28.81 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.086 0.469 . . . . 0.0 110.418 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.761 HD21 ' HG2' ' A' ' 52' ' ' PRO . 52.4 mt -61.86 -31.24 71.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.525 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.529 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 46.5 tt0 -59.43 -42.33 91.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.989 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -67.0 -43.12 83.74 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.266 0.555 . . . . 0.0 110.557 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.524 ' HE2' ' HA ' ' A' ' 57' ' ' LEU . 3.4 mpp? -60.29 -38.52 83.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.34 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.708 HD11 ' N ' ' A' ' 38' ' ' THR . 1.1 mt -61.93 -46.83 95.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.024 0.44 . . . . 0.0 110.389 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.557 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 60.2 t0 -56.45 -26.7 54.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.396 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 60' ' ' MET . 8.9 tp10 -45.77 -37.65 6.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.068 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.866 HG21 ' SD ' ' A' ' 80' ' ' MET . 0.2 OUTLIER -119.96 -13.77 8.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.741 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.544 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 29.2 t70 -86.39 68.12 10.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.521 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -68.02 -17.17 64.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.67 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -12.66 60.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.62 -178.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.89 2.51 82.09 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.507 ' OG ' ' OD1' ' A' ' 65' ' ' ASP . 89.3 p -65.7 -18.24 65.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.838 0.351 . . . . 0.0 110.748 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.523 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 75.0 13.37 82.73 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.586 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.5 p -138.94 130.86 27.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.03 0.443 . . . . 0.0 110.802 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.764 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -96.45 112.8 29.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.917 179.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 14.0 p-10 -82.11 -165.83 1.1 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.371 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 1.017 ' HE1' HD23 ' A' ' 78' ' ' LEU . 2.1 t80 -57.08 -49.75 74.89 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.711 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -64.51 -44.22 91.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.778 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.497 ' OE1' ' HA ' ' A' ' 65' ' ' ASP . 54.8 mt-10 -64.9 -41.61 95.46 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.211 0.529 . . . . 0.0 110.477 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.703 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.53 -40.53 85.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.924 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.017 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -58.37 -38.95 78.3 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 82' ' ' VAL . 47.1 t -61.57 -40.01 85.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.895 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.866 ' SD ' HG21 ' A' ' 64' ' ' VAL . 32.4 mtm -58.36 -39.97 80.99 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 23.8 mmt -61.35 -43.86 98.15 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.011 0.434 . . . . 0.0 110.583 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.649 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.363 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 1.007 HD12 ' SD ' ' A' ' 45' ' ' MET . 21.1 tt . . . . . 0 N--CA 1.462 0.166 0 CA-C-O 120.853 0.359 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.622 ' O ' ' CB ' ' A' ' 153' ' ' MET . 45.0 t -36.41 107.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.925 -179.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.2 87.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.879 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.526 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 65.3 m-20 -55.43 -71.31 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.41 0.624 . . . . 0.0 110.669 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.498 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -62.31 -34.52 76.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.758 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.785 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 6.2 ttt -50.87 -48.92 60.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.449 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.667 ' SD ' ' CD2' ' A' ' 20' ' ' PHE . 1.8 mtp -70.75 -27.89 64.28 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.285 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 86.4 mt-30 -59.37 -45.67 90.8 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.156 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.819 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -75.98 -29.32 58.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.253 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 1.102 HD11 ' CE1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -60.27 -40.18 89.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.689 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' A' ' 22' ' ' ALA . 65.9 mt . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.988 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.579 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.328 0 CA-C-O 121.429 0.633 . . . . 0.0 109.527 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.628 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.5 m-30 -71.05 -31.8 68.34 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.373 0.606 . . . . 0.0 109.584 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -57.17 -45.03 84.03 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.017 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -63.98 -35.89 82.18 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.177 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -56.48 -40.38 74.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.641 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.744 HG13 ' HG ' ' A' ' 78' ' ' LEU . 79.7 t -62.07 -46.59 96.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.69 -24.35 63.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.628 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 23.5 mm100 -70.38 -36.94 74.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.635 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.872 HD12 HD11 ' A' ' 78' ' ' LEU . 23.4 mt -59.9 110.35 1.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.498 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.712 HG23 ' H ' ' A' ' 16' ' ' GLN . 5.0 t -53.92 177.88 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.186 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 24.0 pt-20 -56.98 -37.48 71.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.694 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 79.3 tt0 -75.4 -46.93 29.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.197 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.712 ' H ' HG23 ' A' ' 13' ' ' THR . 11.3 mt-30 -59.85 -48.51 81.39 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.794 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.462 ' CG ' ' HZ ' ' A' ' 74' ' ' PHE . 26.1 ttmt -65.6 -33.36 75.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 66.6 t30 -60.55 -43.44 97.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.292 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.544 ' O ' ' HE3' ' A' ' 154' ' ' MET . 1.1 tt0 -62.05 -51.78 66.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.408 0.623 . . . . 0.0 109.905 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.679 ' CD1' HD13 ' A' ' 12' ' ' LEU . 68.7 m-85 -65.31 -37.76 88.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.053 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -58.01 -40.8 81.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.737 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 1.046 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -61.01 -41.83 97.29 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.99 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -60.05 -38.6 83.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.052 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.861 ' O ' HG22 ' A' ' 28' ' ' VAL . 41.6 t80 -57.37 -48.83 78.02 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.553 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 29' ' ' LEU . 67.0 t0 -61.55 -41.3 97.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.312 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 1.046 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -59.54 -45.38 93.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.535 179.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.751 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 16.0 m-85 -61.13 -40.54 94.18 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.353 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.861 HG22 ' O ' ' A' ' 24' ' ' PHE . 15.0 m -104.27 23.82 2.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.419 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.613 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -52.67 106.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 -179.61 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.34 7.01 67.9 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.539 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -65.52 135.59 55.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.743 0.306 . . . . 0.0 110.389 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.99 -41.39 95.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.175 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.3 p30 -96.91 -19.6 18.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.845 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.631 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 86.97 -8.62 75.57 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.6 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 54.6 p -80.91 136.42 36.05 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.745 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.5 mt -72.94 104.75 2.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.834 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.625 ' HB3' HG22 ' A' ' 71' ' ' THR . 87.2 p -99.79 159.96 14.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.549 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.751 ' N ' HD11 ' A' ' 61' ' ' ILE . 1.3 p -41.57 -32.59 0.37 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.35 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -74.73 -43.42 55.09 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.172 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.653 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . 4.8 mm-40 -74.49 -21.97 59.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.344 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.601 HD22 HD22 ' A' ' 57' ' ' LEU . 3.4 tt -83.32 -50.15 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.839 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.529 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.48 -37.13 94.18 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.653 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -46.4 -59.89 2.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 117.236 0.518 . . . . 0.0 109.986 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.751 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 9.6 t -62.03 -34.09 61.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 1.02 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.5 mmm -58.5 -43.31 89.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.009 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.618 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 21.7 mtt180 -67.24 -32.48 73.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.192 0.52 . . . . 0.0 109.73 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.616 ' HE1' HG22 ' A' ' 44' ' ' VAL . 26.0 mtm -60.79 -37.18 81.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.063 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.678 HD13 ' HA ' ' A' ' 153' ' ' MET . 57.3 mt -89.79 3.84 51.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.537 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.6 -3.62 57.74 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.618 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 8.2 mm100 -85.31 129.52 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.787 0.327 . . . . 0.0 111.137 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -129.19 61.44 57.14 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.906 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.748 ' CG ' HD21 ' A' ' 57' ' ' LEU . 58.7 Cg_endo -73.8 143.86 34.07 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 C-N-CA 122.542 2.161 . . . . 0.0 112.29 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.4 p -73.63 156.98 88.19 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 121.202 0.525 . . . . 0.0 110.551 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.85 -40.24 73.98 Favored 'Trans proline' 0 C--N 1.299 -2.059 0 C-N-CA 122.791 2.327 . . . . 0.0 112.017 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 52.5 mp0 -62.69 -40.4 97.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.391 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 60' ' ' MET . 1.6 tp10 -78.52 -37.77 42.27 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.44 0.638 . . . . 0.0 109.788 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.748 HD21 ' CG ' ' A' ' 52' ' ' PRO . 33.0 mt -61.05 -35.65 77.48 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.476 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -41.77 88.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.403 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -63.47 -41.67 98.59 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 110.028 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.502 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -65.14 -40.99 95.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.751 HD11 ' N ' ' A' ' 38' ' ' THR . 2.6 mt -61.61 -47.09 94.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.803 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.628 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 39.1 t70 -60.28 -29.37 68.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.719 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -54.23 -38.18 65.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.208 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.509 HG11 ' HB2' ' A' ' 80' ' ' MET . 2.2 m -110.51 0.86 9.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.044 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.628 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 57.3 t0 -85.2 109.21 18.15 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.128 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.48 -49.09 72.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.982 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.555 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 51.8 p30 -89.34 -6.18 56.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.755 0.312 . . . . 0.0 110.673 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.447 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 65.66 27.04 72.25 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.615 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.1 p -68.52 4.22 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.858 0.361 . . . . 0.0 110.73 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.55 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.77 16.08 80.48 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.625 HG22 ' HB3' ' A' ' 37' ' ' SER . 4.6 p -141.31 128.91 21.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.745 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -98.95 103.91 15.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.448 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.59 ' OD1' ' CB ' ' A' ' 35' ' ' SER . 66.4 m-20 -74.58 -164.96 0.31 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.39 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 1.001 ' HE1' HD23 ' A' ' 78' ' ' LEU . 4.4 t80 -57.21 -48.48 78.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.63 -48.39 75.05 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.784 0.326 . . . . 0.0 110.823 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.615 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 52.5 mt-10 -62.36 -41.68 98.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.289 0.566 . . . . 0.0 110.463 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.731 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.51 -41.15 84.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.057 0.456 . . . . 0.0 109.823 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.001 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -56.07 -40.65 73.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.595 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.556 ' O ' HG13 ' A' ' 82' ' ' VAL . 43.9 t -61.08 -42.62 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.509 ' HB2' HG11 ' A' ' 64' ' ' VAL . 4.3 ttm -52.22 -44.77 64.99 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.6 mmt -60.28 -46.3 90.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.998 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.628 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.653 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 1.02 HD12 ' SD ' ' A' ' 45' ' ' MET . 19.3 tt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 121.195 0.521 . . . . 0.0 110.366 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.578 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -34.54 107.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.278 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.471 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.73 -39.19 83.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -43.28 -84.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.346 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.435 ' HA ' ' HB2' ' A' ' 155' ' ' GLN . . . -61.19 -33.91 74.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.226 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.679 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 6.3 ttt -48.22 -49.78 31.78 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.288 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.99 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 3.6 mtp -76.42 -27.04 56.13 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.534 179.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 76.0 mt-30 -60.37 -43.19 96.81 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.338 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.627 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -64.1 -44.68 91.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.024 0.44 . . . . 0.0 110.682 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.633 ' N ' HD23 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -62.46 -43.17 99.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.582 -179.287 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.729 HD21 ' HB3' ' A' ' 22' ' ' ALA . 90.1 mt . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.231 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.582 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.205 0.526 . . . . 0.0 109.651 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.6 m-30 -71.29 -29.69 65.36 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.73 -45.73 88.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.07 -34.56 78.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.288 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -58.12 -40.83 82.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.847 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.873 HG22 HD12 ' A' ' 78' ' ' LEU . 94.0 t -62.87 -45.52 98.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -69.94 -26.98 64.39 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.412 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 12.1 mm100 -69.57 -37.9 77.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.588 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.738 HD12 HD11 ' A' ' 78' ' ' LEU . 20.2 mt -56.36 128.49 36.16 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.281 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.727 HG23 ' H ' ' A' ' 16' ' ' GLN . 9.0 t -63.65 179.4 0.48 Allowed 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.092 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -61.4 -41.1 96.6 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.464 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -69.93 -42.12 73.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.84 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.727 ' H ' HG23 ' A' ' 13' ' ' THR . 71.4 mt-30 -61.89 -43.5 98.72 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 5.8 mtmt -71.96 -30.18 65.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.813 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -62.2 -49.05 77.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.227 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.583 ' O ' ' CE ' ' A' ' 154' ' ' MET . 64.4 mt-10 -63.14 -44.72 94.77 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.418 0.627 . . . . 0.0 110.37 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.65 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 39.0 m-85 -67.74 -37.07 81.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.674 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 29.1 tptp -60.78 -40.32 92.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.846 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 1.04 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.01 -42.97 95.45 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.76 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.851 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.07 -39.62 90.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.825 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.654 ' O ' HG22 ' A' ' 28' ' ' VAL . 16.3 t80 -56.65 -48.8 76.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.645 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 29' ' ' LEU . 6.3 t70 -61.72 -41.67 97.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.827 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 1.04 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.26 -44.46 83.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.667 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.984 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 21.3 m-85 -61.92 -40.96 97.27 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.342 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.693 HG13 HG12 ' A' ' 36' ' ' ILE . 31.4 m -106.46 25.38 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.458 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.764 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -54.0 111.17 0.7 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.253 -179.519 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.84 3.06 83.67 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.511 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -62.66 136.6 57.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.353 . . . . 0.0 110.301 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 61.9 mp0 -64.81 -40.31 94.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.459 ' OD1' ' HB3' ' A' ' 35' ' ' SER . 11.0 t70 -96.98 -22.81 16.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.741 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.646 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 89.07 -8.85 78.88 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.592 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 81.4 p -79.69 136.46 36.79 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.759 ' HB ' HG13 ' A' ' 72' ' ' VAL . 94.6 mt -73.77 104.15 2.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.551 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 83.5 p -97.01 168.09 10.67 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.073 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.777 HG22 ' HB3' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -49.16 -38.21 24.83 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.552 -179.471 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.45 -49.17 57.53 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.133 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.551 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 1.4 mp0 -64.51 -43.83 92.83 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.07 0.462 . . . . 0.0 110.743 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.726 HD22 ' HE1' ' A' ' 60' ' ' MET . 4.0 tt -64.98 -49.81 68.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.133 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.58 -31.83 79.17 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.118 -1.193 . . . . 0.0 110.118 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.519 ' HE3' ' O ' ' A' ' 26' ' ' ILE . 0.0 OUTLIER -54.33 -54.05 45.56 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 1.032 HG22 ' SD ' ' A' ' 47' ' ' MET . 1.1 t -66.1 -32.22 57.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.975 ' SD ' HD12 ' A' ' 148' ' ' ILE . 89.5 mmm -59.18 -43.38 92.19 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 78.5 mtp85 -66.98 -37.85 84.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.703 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 1.032 ' SD ' HG22 ' A' ' 44' ' ' VAL . 1.3 ptm -55.08 -29.15 56.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.488 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 148' ' ' ILE . 32.0 mt -94.79 0.02 54.56 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.808 -179.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.42 5.64 54.02 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.708 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 14.8 mm100 -88.86 135.68 33.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.926 0.393 . . . . 0.0 111.242 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.53 ' ND2' HH12 ' A' ' 46' ' ' ARG . 51.4 t-20 -128.67 60.45 49.25 Favored Pre-proline 0 C--N 1.32 -0.705 0 C-N-CA 119.474 -0.891 . . . . 0.0 111.089 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.765 ' HG2' HD11 ' A' ' 57' ' ' LEU . 71.6 Cg_endo -77.05 144.69 24.04 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 C-N-CA 122.659 2.239 . . . . 0.0 112.471 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 p -80.68 153.53 73.2 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.101 0.477 . . . . 0.0 110.458 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.31 -36.69 94.19 Favored 'Trans proline' 0 C--N 1.3 -2.0 0 C-N-CA 122.792 2.328 . . . . 0.0 111.978 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.4 mp0 -62.45 -39.87 94.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.433 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -81.96 -34.42 29.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.908 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.777 ' HB3' HG22 ' A' ' 38' ' ' THR . 32.6 mt -64.93 -39.24 93.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.851 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.501 ' N ' ' CG2' ' A' ' 38' ' ' THR . 7.1 mt-30 -53.53 -50.18 66.02 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.839 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -62.92 -44.05 97.12 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.582 0.706 . . . . 0.0 109.953 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.726 ' HE1' HD22 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -58.52 -42.91 88.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.134 179.104 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.732 HD11 ' N ' ' A' ' 38' ' ' THR . 3.2 mt -60.61 -47.72 91.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.971 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.649 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 18.7 t70 -56.54 -22.31 32.27 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.578 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' MET . 51.6 tp10 -49.97 -39.54 41.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.531 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -115.1 -4.97 11.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.911 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.649 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 53.4 t0 -72.04 114.81 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.602 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -64.63 -46.5 82.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.58 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 59.5 p30 -94.06 -6.27 45.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.868 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 70' ' ' GLY . . . 68.12 23.1 74.61 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.612 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.4 p -69.61 5.72 1.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.836 0.35 . . . . 0.0 110.699 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.683 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.68 17.52 80.0 Favored Glycine 0 CA--C 1.518 0.257 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.592 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.1 p -138.71 122.37 17.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.922 0.392 . . . . 0.0 111.106 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.759 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -99.97 106.19 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.195 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.7 m-20 -73.62 -166.79 0.39 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.507 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.979 ' HE1' HD23 ' A' ' 78' ' ' LEU . 0.8 OUTLIER -57.85 -51.09 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.248 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -63.14 -43.51 98.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.859 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.635 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 68.6 mt-10 -64.62 -39.04 93.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.672 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -72.35 -39.18 68.3 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.198 0.523 . . . . 0.0 110.279 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.979 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.7 -36.58 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -179.352 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.637 ' O ' HG13 ' A' ' 82' ' ' VAL . 48.8 t -59.95 -40.43 82.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.315 0.578 . . . . 0.0 109.732 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.425 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 9.5 ttt -57.2 -43.09 82.4 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.857 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.425 ' HG3' ' CD2' ' A' ' 20' ' ' PHE . 38.8 mmt -60.19 -47.5 85.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.113 0.482 . . . . 0.0 110.547 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.657 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.377 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.975 HD12 ' SD ' ' A' ' 45' ' ' MET . 15.9 tt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.741 0.305 . . . . 0.0 110.346 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.504 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.7 OUTLIER -38.49 102.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.249 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.473 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.66 -39.64 89.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.725 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 3.5 t0 -45.89 -79.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.134 0.492 . . . . 0.0 110.659 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.53 77.36 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.762 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.599 ' O ' ' HG ' ' A' ' 157' ' ' LEU . 11.0 ttt -48.0 -51.6 23.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.323 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.851 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.6 mtp -70.44 -30.16 66.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.363 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 21.9 mt-30 -60.8 -42.54 97.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.022 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.448 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -64.02 -43.79 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.486 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.806 HD22 HG21 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -66.49 -42.79 86.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.675 -179.32 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.502 HD21 ' HB3' ' A' ' 22' ' ' ALA . 75.1 mt . . . . . 0 C--N 1.326 -0.423 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.194 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.597 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.206 0 CA-C-O 121.422 0.63 . . . . 0.0 110.098 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.626 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.9 m-30 -70.3 -32.04 69.64 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -44.02 85.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.491 0.662 . . . . 0.0 109.223 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.78 76.73 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.255 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.86 -40.33 79.92 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.867 HG13 ' HG ' ' A' ' 78' ' ' LEU . 83.8 t -62.84 -45.36 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.42 -23.81 62.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.395 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.38 -34.63 70.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.842 -179.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.782 HD13 ' CE1' ' A' ' 20' ' ' PHE . 15.7 mt -61.55 123.99 19.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.575 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.648 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -60.88 -179.14 0.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.659 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.534 ' N ' ' OG1' ' A' ' 13' ' ' THR . 49.3 tp10 -60.34 -48.37 82.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.892 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -65.69 -43.25 89.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.012 0.434 . . . . 0.0 110.847 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.648 ' H ' HG23 ' A' ' 13' ' ' THR . 4.6 mt-30 -58.17 -50.83 72.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.748 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HD3' ' HZ ' ' A' ' 74' ' ' PHE . 21.3 ttmt -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.955 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -61.11 -46.32 91.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.082 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.478 ' O ' ' HE3' ' A' ' 154' ' ' MET . 0.4 OUTLIER -64.64 -46.08 84.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.487 0.661 . . . . 0.0 110.168 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.782 ' CE1' HD13 ' A' ' 12' ' ' LEU . 43.8 m-85 -62.34 -37.11 84.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.735 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.414 ' NZ ' ' HB2' ' A' ' 74' ' ' PHE . 57.8 tptt -58.56 -38.89 78.81 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 1.078 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.32 -41.56 93.78 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.962 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.67 -38.71 88.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.851 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.866 ' O ' HG22 ' A' ' 28' ' ' VAL . 14.1 t80 -58.29 -49.27 77.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.768 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' A' ' 29' ' ' LEU . 57.4 t0 -61.97 -40.79 96.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 1.078 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -57.91 -44.78 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.812 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.849 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 16.7 m-85 -63.46 -38.12 89.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.049 0.452 . . . . 0.0 110.504 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.866 HG22 ' O ' ' A' ' 24' ' ' PHE . 6.9 m -104.71 21.09 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.684 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.546 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -55.76 101.76 0.06 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.384 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.88 5.06 54.05 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.42 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -69.14 139.17 54.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.682 0.277 . . . . 0.0 110.62 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -66.79 -42.33 86.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.305 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.488 ' OD2' ' OG ' ' A' ' 35' ' ' SER . 56.4 p-10 -99.98 -15.49 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.861 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 89.28 -8.63 79.41 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.621 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 52.7 p -75.73 135.47 40.35 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.829 ' CG1' HG13 ' A' ' 28' ' ' VAL . 85.4 mt -74.71 106.22 4.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.612 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 38.7 t -101.26 157.87 16.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.068 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.656 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -39.16 -43.53 1.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.53 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.11 -41.75 90.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 110.361 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.624 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 6.9 mp0 -75.8 -21.7 57.08 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.454 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.603 ' O ' ' HG2' ' A' ' 45' ' ' MET . 2.6 tt -83.84 -47.94 10.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.842 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.542 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.09 -38.99 96.49 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.624 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.74 -57.87 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.152 0.501 . . . . 0.0 110.283 179.347 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.746 HG11 ' CE1' ' A' ' 27' ' ' PHE . 37.1 t -62.56 -35.02 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.056 177.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.603 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 90.5 mmm -56.53 -43.18 79.58 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.748 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 50.9 mtp180 -64.44 -35.49 81.1 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.074 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.512 ' HE2' ' HA ' ' A' ' 44' ' ' VAL . 19.1 mtm -60.32 -28.59 68.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.116 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.648 HD21 ' HB3' ' A' ' 156' ' ' ALA . 24.7 mt -95.81 5.56 51.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.222 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 95.73 -2.14 64.24 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.592 -1.003 . . . . 0.0 110.592 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.748 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -84.76 135.93 33.92 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 110.869 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.456 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 24.1 p30 -129.97 58.83 40.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.223 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.537 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 65.8 Cg_endo -80.33 146.54 17.6 Favored 'Trans proline' 0 C--N 1.304 -1.808 0 C-N-CA 122.787 2.325 . . . . 0.0 111.926 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 p -80.02 153.08 74.79 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.62 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.23 -40.8 79.8 Favored 'Trans proline' 0 C--N 1.301 -1.93 0 C-N-CA 122.839 2.359 . . . . 0.0 112.081 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.5 mp0 -62.49 -39.32 93.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.29 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.512 ' O ' ' HE1' ' A' ' 60' ' ' MET . 0.2 OUTLIER -80.54 -34.14 35.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.42 179.65 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.586 ' HB3' HG22 ' A' ' 38' ' ' THR . 16.3 mt -62.04 -29.48 70.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.713 179.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.44 -36.4 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.46 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -62.27 -48.75 78.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 0.0 110.901 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.658 ' N ' ' SD ' ' A' ' 60' ' ' MET . 2.0 mpp? -63.53 -39.48 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.524 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.656 HD11 ' N ' ' A' ' 38' ' ' THR . 1.5 mt -61.96 -44.74 99.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.193 0.52 . . . . 0.0 110.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.561 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.9 t70 -59.01 -35.48 73.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.587 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -51.5 -42.46 61.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.684 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.427 HG11 ' HB2' ' A' ' 80' ' ' MET . 3.1 m -106.63 3.54 10.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.681 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.561 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 34.5 t70 -107.74 90.34 3.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.366 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -79.57 -19.18 50.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.37 -11.95 60.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.643 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.48 19.09 68.48 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.0 p -86.32 -7.9 58.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.832 0.348 . . . . 0.0 110.875 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.555 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 74.06 17.45 79.48 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.626 -0.989 . . . . 0.0 110.626 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.621 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.1 p -137.48 128.59 27.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.044 0.449 . . . . 0.0 110.613 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.806 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -97.58 105.43 17.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.503 179.649 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.0 m-20 -74.11 -161.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.69 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 1.034 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.7 t80 -58.79 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.874 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.62 -42.48 98.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.632 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.557 ' C ' HG23 ' A' ' 72' ' ' VAL . 48.0 mt-10 -66.37 -41.38 89.53 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.311 0.577 . . . . 0.0 110.577 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.784 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.85 -37.83 82.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.936 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.034 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -59.1 -40.68 86.06 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.692 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.591 ' O ' HG13 ' A' ' 82' ' ' VAL . 53.8 t -62.15 -39.21 83.09 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.094 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.587 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.485 ' HE3' ' HA ' ' A' ' 77' ' ' PHE . 1.4 ttm -57.02 -42.99 81.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.249 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.49 ' HE3' ' HE1' ' A' ' 77' ' ' PHE . 22.1 mmt -60.51 -45.38 94.0 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.035 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.636 HG12 ' O ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.494 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.601 HG22 ' O ' ' A' ' 148' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.684 0.278 . . . . 0.0 110.483 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.62 ' O ' ' CB ' ' A' ' 153' ' ' MET . 12.5 m -87.95 102.2 14.5 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -52.48 -34.99 51.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.413 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 16.2 t0 -56.79 -80.07 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.231 0.539 . . . . 0.0 110.456 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.554 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -61.57 -34.36 75.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.849 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 4.9 ttt -45.64 -61.45 1.7 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.073 0.463 . . . . 0.0 110.252 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.962 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 6.5 mtp -63.91 -28.19 69.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.185 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 72.8 mt-30 -60.75 -40.64 93.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.194 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.648 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -65.0 -39.92 94.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.392 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.768 ' CB ' HD13 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -73.89 -46.47 44.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.583 -179.494 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 154' ' ' MET . 83.9 mt . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.828 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.622 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.09 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.629 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.9 m-30 -71.66 -31.86 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -46.09 82.91 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.538 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.4 -35.61 81.45 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.551 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -57.32 -40.37 77.78 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.831 HG22 HD12 ' A' ' 78' ' ' LEU . 92.3 t -61.07 -47.14 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -69.12 -30.65 68.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.095 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 92.4 mm-40 -69.4 -36.56 76.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.924 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.81 HD12 HD11 ' A' ' 78' ' ' LEU . 13.5 mt -51.4 125.37 14.18 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.797 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.937 HG23 ' H ' ' A' ' 16' ' ' GLN . 9.9 t -60.66 167.9 2.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.259 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.538 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.8 tm-20 -60.08 -42.27 94.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.777 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -70.8 -50.7 32.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.163 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.937 ' H ' HG23 ' A' ' 13' ' ' THR . 5.9 tt0 -61.89 -44.76 96.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.143 0.497 . . . . 0.0 110.333 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -66.56 -33.43 75.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.773 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.538 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 65.0 t30 -58.25 -42.58 86.71 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.99 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -62.67 -45.48 92.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.032 0.444 . . . . 0.0 110.051 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.655 ' HD1' HD13 ' A' ' 12' ' ' LEU . 12.8 m-85 -64.81 -38.98 92.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.343 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.7 tptp -59.68 -40.93 89.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.727 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.944 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.79 -41.77 96.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.83 -38.76 89.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.004 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.746 ' O ' HG22 ' A' ' 28' ' ' VAL . 23.2 t80 -57.4 -49.13 77.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.649 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.542 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.42 -39.16 92.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.384 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.944 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -57.06 -47.44 83.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.627 -179.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.904 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 25.4 m-85 -61.88 -42.27 98.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.494 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.746 HG22 ' O ' ' A' ' 24' ' ' PHE . 18.9 m -101.2 22.91 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.657 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.582 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -57.75 100.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.408 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.97 -5.58 53.45 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.458 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -60.17 138.24 57.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.835 0.35 . . . . 0.0 110.514 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.87 -41.21 91.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.996 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.66 -22.97 19.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.778 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.684 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 89.0 -9.38 77.02 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.598 ' C ' HG11 ' A' ' 28' ' ' VAL . 89.3 p -82.72 136.2 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.681 ' CG1' HG13 ' A' ' 28' ' ' VAL . 96.4 mt -69.05 104.8 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.597 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.613 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 8.9 p -98.63 156.33 16.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.715 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -39.48 -38.48 0.58 Allowed 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.481 -179.277 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.76 -46.06 76.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.976 0.417 . . . . 0.0 110.171 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.613 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 6.7 mp0 -68.75 -39.42 80.3 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.644 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.945 HD22 HD22 ' A' ' 57' ' ' LEU . 6.4 tt -60.5 -49.05 79.09 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.444 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.578 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.09 -36.27 92.69 Favored Glycine 0 CA--C 1.531 1.033 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -51.23 -62.93 1.32 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.039 0.447 . . . . 0.0 109.99 179.596 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.904 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 4.7 t -58.8 -30.88 43.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.903 178.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.689 ' HE3' ' CG ' ' A' ' 52' ' ' PRO . 81.4 mmm -59.18 -41.99 89.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.281 -0.418 . . . . 0.0 109.874 179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.695 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 77.1 mtp180 -67.61 -31.26 71.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.031 0.443 . . . . 0.0 109.847 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 44' ' ' VAL . 19.8 mtm -61.59 -35.96 79.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.098 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.692 ' CD2' ' HB3' ' A' ' 156' ' ' ALA . 11.0 mt -90.3 2.64 55.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.568 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.69 -1.0 56.72 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.695 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 28.1 mm100 -86.0 134.72 33.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.855 0.359 . . . . 0.0 110.855 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.605 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 31.8 p30 -131.41 60.1 50.17 Favored Pre-proline 0 C--N 1.326 -0.429 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.4 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.689 ' CG ' ' HE3' ' A' ' 45' ' ' MET . 3.6 Cg_exo -75.9 157.83 38.85 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 C-N-CA 123.519 2.812 . . . . 0.0 112.124 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.4 p -89.28 154.2 48.95 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.03 0.443 . . . . 0.0 110.389 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.61 -42.02 71.92 Favored 'Trans proline' 0 C--N 1.302 -1.916 0 C-N-CA 122.716 2.277 . . . . 0.0 112.031 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.16 -44.76 95.89 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.887 0.375 . . . . 0.0 110.262 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.592 ' O ' ' SD ' ' A' ' 60' ' ' MET . 54.2 tp10 -71.64 -38.53 70.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.167 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.945 HD22 HD22 ' A' ' 41' ' ' LEU . 41.9 mt -60.62 -24.11 65.25 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.759 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.435 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 34.9 tt0 -64.3 -39.9 94.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.827 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -61.1 -44.14 97.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.108 0.48 . . . . 0.0 110.758 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -67.53 -39.67 85.05 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.346 179.585 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.715 HD11 ' N ' ' A' ' 38' ' ' THR . 1.4 mt -61.52 -46.06 97.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.439 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 38.2 t70 -59.19 -37.45 77.46 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.589 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.4 tt0 -47.44 -35.03 7.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.543 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 2.5 m -118.51 6.11 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.682 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.455 ' OD2' ' N ' ' A' ' 70' ' ' GLY . 59.0 t0 -117.08 83.24 1.94 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.06 -17.42 63.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 -13.0 60.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.522 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.22 13.68 60.47 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.3 p -76.58 -12.54 60.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.698 0.285 . . . . 0.0 110.995 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.605 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 75.02 16.29 80.65 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.577 ' HA ' ' O ' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -134.48 115.24 13.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.978 0.418 . . . . 0.0 111.101 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.821 HG23 ' N ' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -90.58 105.55 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.199 179.311 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.539 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -72.69 -162.97 0.11 Allowed 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.65 179.678 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.887 ' HE1' HD23 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -58.1 -51.41 69.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.811 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.474 ' O ' HG23 ' A' ' 79' ' ' VAL . 1.2 p30 -65.33 -42.27 93.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.711 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.578 ' O ' ' HB ' ' A' ' 64' ' ' VAL . 53.0 mt-10 -62.36 -42.24 99.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.451 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.821 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -73.89 -42.86 60.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.127 0.489 . . . . 0.0 110.142 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.887 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.11 -34.77 45.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.732 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 82' ' ' VAL . 46.4 t -60.58 -44.06 95.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.002 178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.635 ' HE3' ' CA ' ' A' ' 77' ' ' PHE . 5.2 ptp -56.97 -40.1 75.87 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.053 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.549 ' HE2' ' HG3' ' A' ' 80' ' ' MET . 35.2 mmt -61.55 -45.43 94.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.146 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.213 179.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.766 HD11 ' HG3' ' A' ' 153' ' ' MET . 20.7 tt . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.763 0.316 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.646 ' O ' ' CB ' ' A' ' 153' ' ' MET . 43.0 m -76.17 84.07 3.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -44.28 -37.64 3.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.61 -88.24 0.0 OUTLIER 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.261 0.553 . . . . 0.0 110.907 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.13 -25.95 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.759 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.766 ' HG3' HD11 ' A' ' 148' ' ' ILE . 0.0 OUTLIER -52.36 -49.87 63.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.454 179.754 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.824 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.9 mtp -69.74 -31.47 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.479 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -60.23 -41.87 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.313 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.692 ' HB3' ' CD2' ' A' ' 48' ' ' LEU . . . -65.76 -43.66 88.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.033 0.444 . . . . 0.0 110.966 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.662 ' HB3' HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -63.24 -44.63 94.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.577 -179.433 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 22' ' ' ALA . 83.2 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.221 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.634 HG23 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.382 0 CA-C-O 121.37 0.605 . . . . 0.0 109.476 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.634 ' CD2' HG23 ' A' ' 4' ' ' ILE . 21.0 m-30 -71.88 -30.25 65.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.577 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.2 mmpt? -57.56 -46.11 84.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.553 0.692 . . . . 0.0 109.194 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.484 ' O ' ' HG3' ' A' ' 11' ' ' GLN . . . -63.87 -35.28 80.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.157 177.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.37 -40.95 79.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.663 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.744 HG22 HD12 ' A' ' 78' ' ' LEU . 75.7 t -62.9 -46.28 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -73.6 -20.42 60.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.038 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 7' ' ' ALA . 2.8 mt-30 -71.06 -36.25 72.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.86 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.721 HD13 ' CD1' ' A' ' 20' ' ' PHE . 31.3 mt -56.41 128.01 33.86 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.949 HG23 ' H ' ' A' ' 16' ' ' GLN . 7.5 t -60.67 167.7 2.58 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.959 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -55.42 -39.75 70.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.835 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -74.18 -46.84 39.57 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.745 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.949 ' H ' HG23 ' A' ' 13' ' ' THR . 65.5 tt0 -62.68 -43.97 97.45 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.964 0.411 . . . . 0.0 110.588 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 30.8 ttmt -65.61 -35.55 81.14 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -60.51 -43.71 96.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.853 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.496 ' HG2' HD11 ' A' ' 158' ' ' LEU . 8.7 tt0 -62.66 -46.5 87.91 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.721 ' CD1' HD13 ' A' ' 12' ' ' LEU . 23.5 m-85 -65.07 -39.45 93.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.876 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -59.36 -39.94 84.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.747 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 1.015 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.03 -41.27 91.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.71 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.859 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -60.69 -39.73 89.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.999 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.661 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 29.8 t80 -57.8 -48.91 78.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.846 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 29' ' ' LEU . 47.8 t0 -63.01 -39.23 94.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 1.015 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.8 OUTLIER -57.37 -44.28 83.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.748 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.935 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 14.4 m-85 -61.85 -42.13 98.67 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.056 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.788 HG11 ' O ' ' A' ' 34' ' ' GLY . 6.6 m -101.29 25.14 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.746 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB3' ' HZ1' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -56.28 107.59 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.262 -179.642 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.63 6.15 80.73 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.454 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -64.52 139.42 58.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.547 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -64.24 -41.88 96.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.991 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.51 -22.35 17.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.643 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.788 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 88.02 -8.52 77.9 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.65 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 92.1 p -83.44 136.99 34.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.342 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.639 ' HB ' HG13 ' A' ' 72' ' ' VAL . 97.5 mt -73.45 106.71 3.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.172 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.599 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 32.5 p -102.17 -175.1 2.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.152 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.915 HG23 HD12 ' A' ' 61' ' ' ILE . 6.4 p -64.19 -30.32 71.39 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.442 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.6 mmtt -72.58 -50.53 24.84 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.192 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.599 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 20.4 mp0 -69.68 -40.71 76.22 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.296 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.955 HD22 HD22 ' A' ' 57' ' ' LEU . 8.2 tt -62.32 -51.4 67.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.434 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.479 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.85 -30.34 77.72 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.489 ' HZ1' ' HB3' ' A' ' 29' ' ' LEU . 0.0 OUTLIER -54.56 -49.86 69.32 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.768 0.318 . . . . 0.0 110.262 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 1.056 HG22 ' SD ' ' A' ' 47' ' ' MET . 1.3 t -72.94 -30.41 32.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.808 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.1 mmm -59.31 -45.08 92.27 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.609 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 73.4 mtp85 -67.25 -37.49 83.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 1.056 ' SD ' HG22 ' A' ' 44' ' ' VAL . 1.5 ptm -52.9 -30.23 33.02 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.499 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.617 HD13 ' HA ' ' A' ' 153' ' ' MET . 16.6 mt -93.31 -5.46 49.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.776 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 105.57 7.42 36.89 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.609 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 58.9 mm-40 -85.44 138.86 31.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.777 0.322 . . . . 0.0 111.038 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 30.1 t-20 -126.36 59.14 29.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.376 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.589 ' HG2' HD11 ' A' ' 57' ' ' LEU . 73.4 Cg_endo -80.19 142.04 14.94 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 C-N-CA 122.718 2.279 . . . . 0.0 112.864 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.566 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 63.6 p -81.16 160.5 65.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.376 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -56.86 -36.82 99.07 Favored 'Trans proline' 0 C--N 1.295 -2.271 0 C-N-CA 122.747 2.298 . . . . 0.0 111.761 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -62.18 -49.47 75.66 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.978 0.418 . . . . 0.0 110.763 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.574 ' OE2' ' HB2' ' A' ' 52' ' ' PRO . 1.3 pp20? -72.56 -34.99 67.88 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.955 HD22 HD22 ' A' ' 41' ' ' LEU . 38.2 mt -65.16 -41.7 94.43 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.584 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.466 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 29.0 tt0 -61.93 -42.22 98.84 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.18 -179.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -62.55 -51.8 65.95 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.426 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.792 ' CE ' HD21 ' A' ' 41' ' ' LEU . 2.5 ppp? -58.49 -34.65 71.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.035 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.915 HD12 HG23 ' A' ' 38' ' ' THR . 15.5 mt -60.92 -44.57 98.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.082 0.468 . . . . 0.0 110.807 177.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.634 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 34.1 t70 -61.0 -27.43 68.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.854 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -49.4 -38.44 28.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.62 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -111.95 -3.78 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.732 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.634 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 51.4 t0 -79.65 104.78 10.48 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.195 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -63.62 -45.59 89.61 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.418 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.573 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 54.6 p30 -91.38 -0.19 57.61 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.839 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.539 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 60.42 29.75 69.92 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.608 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 3.0 p -69.79 -0.02 6.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.839 0.352 . . . . 0.0 110.763 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.564 ' N ' ' OD2' ' A' ' 65' ' ' ASP . . . 76.77 14.23 82.76 Favored Glycine 0 CA--C 1.521 0.409 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.65 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.0 p -139.74 132.51 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -101.64 110.0 27.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.002 179.173 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.451 ' CG ' ' OE1' ' A' ' 76' ' ' GLU . 55.2 p-10 -78.98 -169.05 1.65 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.227 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.881 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.1 t80 -55.64 -50.09 71.13 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.452 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.543 ' O ' HG23 ' A' ' 79' ' ' VAL . 98.2 m-20 -62.43 -42.77 99.7 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.118 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' A' ' 65' ' ' ASP . 25.7 mt-10 -64.81 -42.07 95.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.381 0.61 . . . . 0.0 110.354 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.683 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -69.62 -44.9 69.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.916 179.532 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.881 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -57.05 -37.21 71.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.757 ' O ' HG13 ' A' ' 82' ' ' VAL . 42.1 t -60.97 -43.25 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.207 178.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.428 ' HB2' HG11 ' A' ' 64' ' ' VAL . 1.6 ttm -54.48 -42.76 71.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.536 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 14.4 mmt -59.85 -45.45 92.39 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.49 . . . . 0.0 110.282 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 79' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.434 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.862 ' O ' HG23 ' A' ' 148' ' ' ILE . 11.1 tt . . . . . 0 N--CA 1.461 0.104 0 CA-C-O 120.635 0.255 . . . . 0.0 110.8 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.564 ' C ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -26.88 111.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.635 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.508 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.67 -39.49 88.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.483 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -44.69 -80.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.132 0.492 . . . . 0.0 110.457 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.81 -35.81 77.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.773 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.705 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 13.6 ttt -49.94 -51.84 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.885 0.374 . . . . 0.0 110.291 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.859 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 16.1 mtp -69.43 -32.04 70.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.472 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.554 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.6 mt-30 -59.9 -42.06 93.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.103 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.495 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.52 -42.88 98.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.388 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.758 HD22 HG21 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -66.65 -38.04 86.05 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.55 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.496 HD11 ' HG2' ' A' ' 19' ' ' GLU . 86.9 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.383 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.623 HD13 ' C ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.069 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.65 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.1 m-30 -68.65 -33.68 74.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.562 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -56.89 -46.86 81.63 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.583 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -62.55 -35.71 80.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -55.66 -40.95 72.96 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.251 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.786 HG22 HD12 ' A' ' 78' ' ' LEU . 68.8 t -63.14 -46.95 94.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.91 -23.3 61.45 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.543 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 84.2 mm-40 -70.43 -35.72 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.658 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.7 ' CD1' HD11 ' A' ' 78' ' ' LEU . 21.9 mt -57.76 126.09 25.85 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.641 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.876 HG23 ' H ' ' A' ' 16' ' ' GLN . 1.5 t -64.12 175.19 1.31 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.284 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.0 mm-40 -60.88 -43.06 98.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.59 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -71.55 -48.14 50.5 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.876 ' H ' HG23 ' A' ' 13' ' ' THR . 8.1 tt0 -61.18 -43.86 98.21 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.295 0.569 . . . . 0.0 110.393 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -68.26 -32.23 72.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.63 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.2 t-20 -60.87 -44.24 97.33 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.884 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -60.71 -44.37 96.68 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.129 0.49 . . . . 0.0 109.835 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.653 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 30.6 m-85 -66.76 -38.04 85.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.847 179.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -60.25 -40.11 89.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.074 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.915 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -59.79 -42.02 92.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.741 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.66 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -62.21 -40.29 95.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.582 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 16.8 t80 -57.64 -49.17 77.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.787 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 29' ' ' LEU . 36.1 t70 -63.49 -40.16 96.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.606 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.97 HD13 ' CB ' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -57.81 -44.02 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.584 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.779 ' CE1' HG11 ' A' ' 44' ' ' VAL . 17.4 m-85 -61.71 -43.12 99.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.738 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.666 HG21 ' O ' ' A' ' 34' ' ' GLY . 28.0 m -102.9 26.96 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.621 ' HB3' ' HZ1' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -57.49 105.67 0.26 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.376 -179.722 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 3.4 67.82 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.485 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -63.44 136.44 57.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.289 . . . . 0.0 110.368 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -61.81 -44.79 96.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.544 ' OD1' ' O ' ' A' ' 33' ' ' ASP . 64.6 t0 -92.43 -22.37 19.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.666 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 88.51 -8.04 80.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.547 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 59.5 p -81.15 137.52 35.93 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.631 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.657 HG12 HG13 ' A' ' 28' ' ' VAL . 96.6 mt -74.19 105.8 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.056 0.455 . . . . 0.0 110.974 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.682 ' CB ' HG22 ' A' ' 71' ' ' THR . 4.8 p -102.45 -172.49 2.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.693 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.608 ' O ' HD13 ' A' ' 57' ' ' LEU . 16.3 p -60.88 -37.18 81.27 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.437 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -69.93 -49.18 54.53 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.337 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.583 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 46.9 mp0 -64.35 -42.9 96.0 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.846 HD23 HD22 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -64.06 -48.54 75.83 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.89 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.2 -37.55 94.71 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.581 -1.008 . . . . 0.0 110.581 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.621 ' HZ1' ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -50.37 -63.45 1.12 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 109.851 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.904 HG22 ' HE2' ' A' ' 47' ' ' MET . 13.2 t -59.45 -36.29 63.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.662 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 77.8 mmm -55.35 -39.5 70.12 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.667 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 10.4 mtm105 -66.68 -32.85 74.42 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.904 ' HE2' HG22 ' A' ' 44' ' ' VAL . 32.6 mtm -59.18 -37.43 77.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.783 HD22 ' N ' ' A' ' 48' ' ' LEU . 2.3 mm? -83.76 -5.33 59.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.623 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.37 11.22 34.14 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.667 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -91.25 138.74 31.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.154 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.452 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 34.6 p30 -127.24 57.75 25.75 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.892 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.514 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 68.9 Cg_endo -78.47 150.4 25.02 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.711 2.274 . . . . 0.0 112.56 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.7 p -89.96 156.51 46.78 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.597 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.504 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 52.3 Cg_exo -55.6 -40.26 86.35 Favored 'Trans proline' 0 C--N 1.301 -1.935 0 C-N-CA 122.762 2.308 . . . . 0.0 111.909 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -61.3 -49.65 76.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.497 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.458 ' O ' ' SD ' ' A' ' 60' ' ' MET . 78.7 mm-40 -69.37 -38.99 78.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.18 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.846 HD22 HD23 ' A' ' 41' ' ' LEU . 26.3 mt -60.25 -28.43 68.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.698 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -58.87 -40.02 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.126 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -63.49 -47.85 80.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.631 0.729 . . . . 0.0 110.779 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.547 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.17 -38.9 90.85 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.914 179.698 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.777 HG21 ' O ' ' A' ' 70' ' ' GLY . 17.3 mm -62.36 -45.56 98.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.362 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.638 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.0 t70 -64.26 -23.14 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.807 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -53.66 -41.08 66.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.572 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.526 HG11 ' HB3' ' A' ' 80' ' ' MET . 0.9 OUTLIER -114.68 -3.52 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.4 . . . . 0.0 110.718 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.638 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 63.5 t0 -88.16 88.67 7.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -71.88 -26.74 62.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.924 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.56 -11.46 60.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.967 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.04 21.73 64.06 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.019 -0.833 . . . . 0.0 111.019 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 p -85.93 0.7 52.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.887 0.375 . . . . 0.0 110.747 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.777 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 72.69 15.51 77.84 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.682 HG22 ' CB ' ' A' ' 37' ' ' SER . 9.8 p -139.43 126.9 21.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.903 0.382 . . . . 0.0 110.657 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.691 HG22 ' O ' ' A' ' 72' ' ' VAL . 0.2 OUTLIER -91.37 107.72 19.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.348 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.463 ' OD1' ' CG ' ' A' ' 76' ' ' GLU . 52.3 p-10 -74.34 -169.08 0.75 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.508 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 1.027 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.8 t80 -57.41 -50.69 72.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 -179.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -62.93 -41.92 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.816 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.614 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 30.8 mt-10 -64.87 -43.26 93.52 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.189 0.519 . . . . 0.0 110.381 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.707 ' HA ' ' HE3' ' A' ' 80' ' ' MET . 0.0 OUTLIER -68.88 -39.76 79.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.443 0.639 . . . . 0.0 109.724 179.739 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.027 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -60.38 -37.03 79.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.431 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.621 ' O ' HG13 ' A' ' 82' ' ' VAL . 28.3 t -61.88 -42.28 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.967 178.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.707 ' HE3' ' HA ' ' A' ' 77' ' ' PHE . 2.6 ptp -56.48 -38.54 71.87 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.878 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.425 ' N ' ' CG ' ' A' ' 80' ' ' MET . 21.1 mmt -62.42 -47.76 82.67 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.65 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.502 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.292 179.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.464 HG23 ' O ' ' A' ' 148' ' ' ILE . 5.4 tp . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.747 0.308 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.61 ' O ' ' CB ' ' A' ' 153' ' ' MET . 29.6 m -71.87 88.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.986 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.585 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.62 -31.95 69.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.834 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -53.02 -48.69 67.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.038 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.405 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -107.56 -18.98 13.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.954 0.407 . . . . 0.0 111.064 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.726 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -57.12 -45.98 83.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.226 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.66 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 mtp -70.01 -29.82 66.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.577 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.405 ' OE1' ' HA ' ' A' ' 152' ' ' ALA . 82.3 mt-30 -62.05 -39.61 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.449 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' A' ' 48' ' ' LEU . . . -62.27 -25.27 67.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.781 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.97 ' CB ' HD13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -97.13 -51.97 4.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.756 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 22' ' ' ALA . 94.6 mt . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.543 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.718 ' C ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.637 ' HA ' HG21 ' A' ' 82' ' ' VAL . 20.9 m-30 -69.2 -31.89 70.8 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.551 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.76 -45.37 89.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.05 -34.15 76.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.511 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -58.39 -42.01 86.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.758 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.838 HG22 HD12 ' A' ' 78' ' ' LEU . 95.4 t -63.71 -43.95 98.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -68.58 -24.3 64.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.522 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -71.15 -35.4 71.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.691 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.832 HD13 ' CD1' ' A' ' 20' ' ' PHE . 17.2 mt -64.5 107.8 1.48 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.277 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.706 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -51.21 -179.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.649 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.553 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 76.5 mm-40 -60.92 -44.77 96.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.981 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -70.92 -45.7 63.8 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.95 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.706 ' H ' HG23 ' A' ' 13' ' ' THR . 29.5 tt0 -63.66 -44.34 94.08 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.178 0.514 . . . . 0.0 110.127 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.586 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.6 ttmt -70.44 -30.83 67.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.589 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.553 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 63.0 t30 -60.33 -44.46 95.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.106 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.41 -45.44 93.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.106 0.479 . . . . 0.0 109.947 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.832 ' CD1' HD13 ' A' ' 12' ' ' LEU . 28.4 m-85 -65.11 -39.01 92.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.198 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -60.53 -39.51 88.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.836 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.895 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.53 -42.22 96.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.852 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.753 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.66 -39.41 91.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.181 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.707 ' O ' HG22 ' A' ' 28' ' ' VAL . 17.2 t80 -57.27 -48.63 78.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.638 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.587 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.75 -39.55 94.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.527 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.895 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -56.65 -45.88 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.528 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.709 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 22.6 m-85 -62.03 -41.99 98.69 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.365 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.707 HG22 ' O ' ' A' ' 24' ' ' PHE . 15.7 m -101.57 21.36 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.427 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -53.12 112.47 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.325 -179.825 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.32 -9.07 78.35 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.595 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -63.15 127.03 29.38 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.247 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.11 -41.39 97.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.56 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.5 p30 -81.36 -22.38 38.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.874 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.56 ' N ' ' OD1' ' A' ' 33' ' ' ASP . . . 78.73 -2.5 68.01 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.58 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 57.6 p -90.6 136.93 32.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.878 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -73.6 106.22 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.662 -0.415 . . . . 0.0 111.358 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.585 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 56.1 p -101.94 161.65 13.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.798 179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.86 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -41.66 -35.58 0.79 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.611 -179.339 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -49.54 57.31 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.585 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 3.4 mp0 -67.18 -40.06 86.51 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.877 ' CD2' HD22 ' A' ' 57' ' ' LEU . 6.6 tt -60.06 -50.44 73.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.44 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.458 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.93 -35.74 92.26 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.5 -60.98 2.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.22 0.534 . . . . 0.0 109.947 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.85 HG22 ' HE2' ' A' ' 47' ' ' MET . 25.5 t -61.06 -38.93 80.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 177.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.636 ' HB3' ' HB2' ' A' ' 50' ' ' GLN . 88.8 mmm -54.46 -41.6 69.67 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 71.6 mtp180 -65.01 -32.65 74.49 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.85 ' HE2' HG22 ' A' ' 44' ' ' VAL . 33.1 mtm -58.7 -37.3 75.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.828 ' N ' HD22 ' A' ' 48' ' ' LEU . 2.1 mm? -85.76 0.01 54.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.516 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.36 5.45 57.01 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.645 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 5.8 mm-40 -80.53 138.49 36.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.961 0.41 . . . . 0.0 110.955 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.463 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 26.6 p-10 -128.54 56.79 24.28 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.309 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.7 ' CG ' HD21 ' A' ' 57' ' ' LEU . 64.0 Cg_endo -77.67 139.86 18.27 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.721 2.281 . . . . 0.0 112.864 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.6 p -78.6 158.16 76.29 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.47 -35.21 84.57 Favored 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.726 2.284 . . . . 0.0 111.824 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -61.02 -51.6 68.53 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.21 0.529 . . . . 0.0 110.387 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.579 ' O ' ' CE ' ' A' ' 60' ' ' MET . 72.9 mt-10 -69.64 -39.89 76.84 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.327 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.877 HD22 ' CD2' ' A' ' 41' ' ' LEU . 43.4 mt -61.48 -37.75 84.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.678 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.527 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 50.6 tt0 -59.8 -41.36 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.733 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -62.85 -41.86 99.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.255 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.579 ' CE ' ' O ' ' A' ' 56' ' ' GLU . 4.4 mmt -62.57 -39.09 92.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.86 HD11 ' N ' ' A' ' 38' ' ' THR . 2.8 mt -61.65 -45.7 98.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.489 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 14.9 t70 -60.14 -36.08 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.565 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -45.98 -38.91 8.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.157 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.483 HG11 ' HB3' ' A' ' 80' ' ' MET . 0.6 OUTLIER -113.88 -10.11 12.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.555 ' OD1' ' OG ' ' A' ' 69' ' ' SER . 16.0 t70 -96.65 67.37 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.323 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -67.71 -17.62 64.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.793 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.466 ' OD1' ' OD2' ' A' ' 65' ' ' ASP . 49.6 p-10 -75.93 -10.3 59.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.496 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.68 14.45 75.26 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.555 ' OG ' ' OD1' ' A' ' 65' ' ' ASP . 88.1 p -71.86 -16.84 62.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.617 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.46 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 72.97 17.04 78.34 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.583 ' CG2' ' HB3' ' A' ' 37' ' ' SER . 0.2 OUTLIER -149.2 119.43 7.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.924 0.392 . . . . 0.0 110.76 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.878 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.1 OUTLIER -85.99 110.38 19.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.44 179.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.543 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -81.49 -162.29 0.5 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.886 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.9 t80 -56.72 -49.52 74.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.775 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.468 ' O ' HG23 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -65.6 -44.96 85.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.644 179.526 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.62 ' C ' HG23 ' A' ' 72' ' ' VAL . 53.2 mt-10 -62.69 -41.37 99.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.321 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.759 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -71.04 -44.34 66.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.186 0.517 . . . . 0.0 109.634 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.886 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.1 -37.33 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.619 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.539 ' HA ' ' CG1' ' A' ' 82' ' ' VAL . 42.6 t -63.84 -41.73 93.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.037 178.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.735 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -54.25 -38.34 65.68 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.204 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.735 ' N ' ' HG2' ' A' ' 80' ' ' MET . 12.7 mmt -65.36 -48.25 73.61 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 121.255 0.55 . . . . 0.0 110.848 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.637 HG21 ' HA ' ' A' ' 5' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.613 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.546 ' O ' HG23 ' A' ' 148' ' ' ILE . 12.6 tt . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.743 0.306 . . . . 0.0 110.485 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.576 ' O ' ' CB ' ' A' ' 153' ' ' MET . 3.4 m -70.19 103.73 2.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.387 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.499 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.85 -38.81 83.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.341 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.613 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -45.02 -82.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.435 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -60.41 -35.2 75.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.805 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.601 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 9.5 ttt -49.74 -52.41 31.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.245 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.753 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.7 mtp -71.1 -29.21 64.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.481 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 52.7 mt-30 -60.3 -44.09 95.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.345 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.81 98.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.077 0.465 . . . . 0.0 110.17 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -64.37 -42.13 96.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.642 -179.533 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.405 -179.826 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.61 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.283 0 CA-C-O 121.025 0.44 . . . . 0.0 109.982 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.668 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.2 m-30 -69.95 -34.0 72.85 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.604 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -54.9 -45.61 74.74 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.302 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 11' ' ' GLN . . . -65.1 -33.27 75.63 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.601 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.84 -40.27 83.75 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.877 HG22 HD12 ' A' ' 78' ' ' LEU . 95.1 t -61.98 -46.13 97.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.046 0.45 . . . . 0.0 109.788 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -73.42 -23.78 60.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 7' ' ' ALA . 3.1 mm-40 -72.03 -38.6 69.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.779 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.76 HD12 HD11 ' A' ' 78' ' ' LEU . 21.5 mt -49.4 118.72 2.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.734 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.657 HG22 ' HB2' ' A' ' 16' ' ' GLN . 8.8 t -56.33 -177.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.374 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.548 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 88.0 tt0 -60.04 -44.01 94.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.434 ' H ' HG23 ' A' ' 13' ' ' THR . 86.5 tt0 -74.0 -51.23 16.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.657 ' HB2' HG22 ' A' ' 13' ' ' THR . 13.0 mt-30 -50.47 -52.76 35.23 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.591 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.0 ttmt -66.18 -35.06 79.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.046 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.548 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 62.2 t30 -59.6 -43.77 93.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.199 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.48 ' O ' ' HE3' ' A' ' 154' ' ' MET . 12.6 mt-10 -61.02 -46.92 88.78 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.196 0.522 . . . . 0.0 110.492 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.64 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 67.4 m-85 -66.15 -38.54 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.224 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -56.5 -42.58 78.57 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.993 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.77 -40.86 94.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.915 178.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.866 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.185 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.675 ' O ' HG22 ' A' ' 28' ' ' VAL . 15.9 t80 -57.32 -48.23 79.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.444 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.609 ' O ' ' N ' ' A' ' 29' ' ' LEU . 64.6 t0 -62.23 -40.02 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.393 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.993 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.33 -46.35 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.75 179.674 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.791 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 12.9 m-85 -60.66 -41.32 94.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.459 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.801 HG13 HG12 ' A' ' 36' ' ' ILE . 25.1 m -107.22 25.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.619 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.656 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -56.97 105.93 0.26 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.305 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.49 -9.32 58.94 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.595 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -64.14 129.76 41.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.806 0.336 . . . . 0.0 110.517 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.63 -43.85 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.779 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 50.2 p30 -80.09 -23.36 41.33 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.834 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.6 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 79.68 1.81 87.32 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.649 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 75.4 p -90.98 135.67 33.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.625 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.832 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -77.6 110.46 13.31 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.101 -179.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.587 ' C ' HD11 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -108.86 -178.58 3.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.05 178.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.611 ' N ' HD11 ' A' ' 61' ' ' ILE . 2.8 p -58.58 -24.23 60.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.516 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -84.46 -48.37 9.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.229 178.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.677 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 60.3 mp0 -71.96 -20.81 61.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.581 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.975 HD22 HD22 ' A' ' 57' ' ' LEU . 10.0 tt -83.2 -49.28 9.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.951 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.553 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -60.15 -38.08 93.87 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.677 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.41 -58.22 4.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.731 0.3 . . . . 0.0 110.305 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.834 ' CG2' HG22 ' A' ' 26' ' ' ILE . 3.0 t -62.85 -32.09 54.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.595 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 89.6 mmm -60.19 -42.61 95.43 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.716 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 40.1 mtp180 -67.45 -32.04 72.63 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.637 ' HE2' HG22 ' A' ' 44' ' ' VAL . 26.8 mtm -59.53 -36.65 76.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.881 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.581 HD21 ' HB3' ' A' ' 156' ' ' ALA . 73.4 mt -88.59 -0.79 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.314 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.6 4.15 52.54 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.716 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 25.2 mm100 -90.34 135.27 33.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.972 0.415 . . . . 0.0 110.574 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.557 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 34.1 t-20 -134.11 60.99 48.29 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.892 ' HG2' HD21 ' A' ' 57' ' ' LEU . 60.2 Cg_endo -75.46 149.14 34.48 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.684 2.256 . . . . 0.0 112.41 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.623 ' OG1' ' OE1' ' A' ' 56' ' ' GLU . 62.6 p -81.64 161.68 60.65 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.056 0.455 . . . . 0.0 110.623 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 47.1 Cg_exo -54.63 -39.36 89.14 Favored 'Trans proline' 0 C--N 1.303 -1.821 0 C-N-CA 122.71 2.273 . . . . 0.0 111.837 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -62.77 -50.49 70.85 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.154 0.502 . . . . 0.0 110.827 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.623 ' OE1' ' OG1' ' A' ' 53' ' ' THR . 21.9 mp0 -67.94 -39.68 83.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.841 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.975 HD22 HD22 ' A' ' 41' ' ' LEU . 23.0 mt -62.09 -39.37 92.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.754 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -59.43 -40.66 87.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.34 -49.33 76.01 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.026 0.441 . . . . 0.0 111.203 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.814 ' SD ' HD23 ' A' ' 57' ' ' LEU . 2.3 ptp -64.74 -35.16 80.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.489 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.72 HG12 HD13 ' A' ' 41' ' ' LEU . 1.1 mt -62.63 -46.61 95.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.075 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 13.2 t70 -61.45 -30.22 70.44 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -47.1 -37.14 9.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.283 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 1.5 m -114.52 -16.3 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.662 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.564 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 38.8 t70 -88.25 78.31 8.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.47 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -72.77 -11.65 60.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.782 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.53 -12.13 60.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.532 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.29 14.07 68.38 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 85.7 p -85.1 -6.41 59.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 110.713 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.535 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 71.51 17.88 76.66 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.649 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 0.9 OUTLIER -138.45 124.12 19.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.934 0.397 . . . . 0.0 110.76 -179.636 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.832 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -90.12 117.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.421 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.51 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 45.3 p-10 -82.26 -168.12 1.85 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.609 179.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.98 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -56.84 -51.06 70.48 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.714 -179.521 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.67 -42.59 95.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.899 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.604 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 46.4 mt-10 -64.49 -42.05 96.09 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.109 0.48 . . . . 0.0 110.575 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.731 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -70.29 -43.19 70.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.797 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.98 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.92 -37.79 61.15 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.575 ' O ' HG13 ' A' ' 82' ' ' VAL . 39.7 t -61.56 -45.87 97.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.162 0.506 . . . . 0.0 110.42 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.714 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -53.6 -36.88 62.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.305 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.714 ' N ' ' HG2' ' A' ' 80' ' ' MET . 24.7 mmt -66.55 -50.0 64.6 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.198 0.523 . . . . 0.0 110.494 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.668 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.62 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.306 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.574 HD12 ' SD ' ' A' ' 45' ' ' MET . 18.7 tt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.727 0.299 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . 0.65 ' O ' ' CB ' ' A' ' 153' ' ' MET . 68.4 m -67.37 92.91 0.3 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.254 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -50.04 -34.09 20.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.514 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.534 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -62.17 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.229 0.537 . . . . 0.0 110.891 179.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -60.46 -30.92 69.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.554 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . 0.791 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 ttt -50.96 -54.5 23.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.652 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' MET . . . . . 0.866 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.9 mtp -65.77 -31.84 73.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.193 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.3 mt-30 -60.69 -41.47 95.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.882 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . 0.581 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.57 -39.89 95.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.095 0.474 . . . . 0.0 110.267 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.688 HD22 HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -71.6 -48.08 50.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.27 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' A' ' 22' ' ' ALA . 91.9 mt . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.777 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.697 ' CE ' HG21 ' A' ' 79' ' ' VAL . 2.1 tpt . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.45 129.1 39.55 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.287 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 68.8 m-20 -70.08 -38.65 75.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.701 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.577 ' C ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -58.09 -44.03 86.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.405 -0.518 . . . . 0.0 109.796 -179.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.644 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.0 m-30 -72.9 -29.33 63.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.606 178.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -59.02 -46.49 88.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.579 -0.896 . . . . 0.0 108.579 179.305 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.78 -35.92 81.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.455 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.67 -40.88 80.39 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.6 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.035 HG22 HD12 ' A' ' 78' ' ' LEU . 75.4 t -62.48 -47.3 93.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.626 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -66.64 -24.76 66.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.648 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -70.47 -36.32 73.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.045 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 78' ' ' LEU . 57.6 mt -58.53 127.9 34.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.266 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 1.025 HG23 ' H ' ' A' ' 16' ' ' GLN . 4.4 t -61.87 171.37 1.68 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -60.69 -39.98 90.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.17 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.64 -48.81 45.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 1.025 ' H ' HG23 ' A' ' 13' ' ' THR . 64.5 tt0 -62.61 -42.73 99.75 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.132 0.492 . . . . 0.0 110.585 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 32.3 ttmt -66.81 -35.24 79.61 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.689 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -59.34 -44.07 92.69 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.488 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -61.84 -44.78 96.14 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.402 0.62 . . . . 0.0 109.957 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.673 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 14.1 m-30 -64.45 -38.66 91.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.766 179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 24' ' ' PHE . 24.7 tptm -59.09 -39.76 83.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.88 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.798 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -59.65 -42.62 93.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.845 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.54 -38.53 87.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.01 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.639 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 17.3 t80 -56.57 -49.56 74.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.607 ' O ' ' N ' ' A' ' 29' ' ' LEU . 61.6 t0 -62.27 -39.23 92.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.263 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.798 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.5 OUTLIER -56.4 -44.48 80.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.669 179.896 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.652 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 16.8 m-85 -62.17 -42.71 99.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.375 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.687 HG13 ' CG1' ' A' ' 36' ' ' ILE . 6.2 m -97.51 11.37 5.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.741 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.607 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -42.03 108.06 0.09 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.06 12.74 58.57 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.651 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -83.9 128.76 34.77 Favored 'General case' 0 C--N 1.331 -0.239 0 O-C-N 122.777 -0.249 . . . . 0.0 110.555 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -64.18 -40.73 96.72 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.701 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -21.96 25.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.565 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 81.35 -1.23 86.11 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.591 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 55.6 p -86.16 135.46 33.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.687 ' CG1' HG13 ' A' ' 28' ' ' VAL . 89.6 mt -76.87 105.65 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.106 0.479 . . . . 0.0 110.709 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.864 ' HB3' HG22 ' A' ' 71' ' ' THR . 60.3 p -103.33 177.49 4.83 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.701 HG22 ' C ' ' A' ' 57' ' ' LEU . 6.9 p -53.32 -39.59 64.15 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.043 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -66.47 -44.44 82.71 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.706 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.634 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 71.1 mm-40 -73.53 -20.69 60.58 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 109.956 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.609 ' O ' ' HG2' ' A' ' 45' ' ' MET . 0.4 OUTLIER -81.82 -47.37 12.92 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.54 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.504 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -60.94 -37.94 94.63 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.369 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.634 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -48.69 -57.29 6.51 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.203 0.502 . . . . 0.0 110.276 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.757 HG21 HG22 ' A' ' 26' ' ' ILE . 11.8 t -63.67 -35.63 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 CA-C-O 121.097 0.475 . . . . 0.0 110.019 177.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.609 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 87.5 mmm -59.06 -41.58 88.26 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.636 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 76.5 mtp85 -66.42 -33.16 75.08 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.556 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 20.5 mtm -59.75 -38.28 81.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.969 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.624 HD11 ' HG3' ' A' ' 153' ' ' MET . 79.3 mt -84.19 -1.87 55.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.857 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.41 8.77 52.25 Favored Glycine 0 CA--C 1.529 0.906 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.636 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 87.0 mm-40 -90.83 138.08 31.86 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.855 0.36 . . . . 0.0 111.078 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.466 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 21.0 t-20 -127.38 60.89 46.1 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.81 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.652 ' HG2' HD11 ' A' ' 57' ' ' LEU . 81.7 Cg_endo -79.32 139.89 15.02 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.573 2.182 . . . . 0.0 112.169 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 73.8 p -74.25 152.31 88.09 Favored Pre-proline 0 CA--C 1.516 -0.34 0 CA-C-O 121.037 0.446 . . . . 0.0 110.323 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.13 -43.06 60.0 Favored 'Trans proline' 0 C--N 1.297 -2.181 0 C-N-CA 122.722 2.281 . . . . 0.0 112.294 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -62.74 -40.28 96.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.168 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.434 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 0.9 OUTLIER -78.84 -31.89 45.88 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.701 ' C ' HG22 ' A' ' 38' ' ' THR . 3.1 mt -60.96 -26.27 67.42 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.16 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.56 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 37.7 tt0 -58.93 -37.74 77.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.723 -178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -61.58 -41.28 97.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.158 0.504 . . . . 0.0 110.804 178.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.492 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 3.6 mmt -64.51 -42.02 96.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.763 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.562 HG21 ' O ' ' A' ' 70' ' ' GLY . 10.2 mm -61.62 -44.56 98.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.696 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.507 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 66.0 t0 -59.79 -29.91 68.53 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.33 -42.88 10.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.972 0.415 . . . . 0.0 110.338 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.472 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 0.3 OUTLIER -113.2 -12.34 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.267 179.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.513 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 30.7 t70 -91.98 63.24 4.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.399 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.598 ' OE1' ' N ' ' A' ' 1' ' ' MET . 85.2 tt0 -65.21 -21.0 66.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.821 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.413 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 58.7 p-10 -74.67 -8.48 56.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.896 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.74 15.17 75.69 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.4 m -66.21 -26.74 67.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.927 0.394 . . . . 0.0 110.405 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.562 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 86.41 -1.14 87.34 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.864 HG22 ' HB3' ' A' ' 37' ' ' SER . 25.6 p -136.44 133.77 36.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.922 0.391 . . . . 0.0 110.926 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.732 HG22 ' O ' ' A' ' 72' ' ' VAL . 0.2 OUTLIER -100.48 103.82 15.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.217 0.532 . . . . 0.0 109.972 179.212 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.538 ' OD1' ' HA ' ' A' ' 35' ' ' SER . 18.1 m-20 -72.27 -163.9 0.13 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.302 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 1.02 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.4 t80 -57.86 -49.88 75.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.004 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.464 ' O ' HG23 ' A' ' 79' ' ' VAL . 97.3 m-20 -62.99 -42.29 99.8 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.017 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.534 ' CD ' ' HA ' ' A' ' 72' ' ' VAL . 45.5 mt-10 -64.38 -42.09 96.33 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.385 0.612 . . . . 0.0 111.132 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.713 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -71.33 -41.13 70.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.999 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.035 HD12 HG22 ' A' ' 9' ' ' VAL . 0.3 OUTLIER -58.39 -37.22 74.83 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -179.846 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.697 HG21 ' CE ' ' A' ' 1' ' ' MET . 42.1 t -60.69 -42.53 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 N-CA-C 109.335 -0.616 . . . . 0.0 109.335 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.508 ' HA ' ' HD3' ' A' ' 83' ' ' ARG . 1.0 OUTLIER -53.27 -43.53 67.5 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.916 -0.714 . . . . 0.0 110.083 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.654 ' O ' ' SD ' ' A' ' 85' ' ' MET . 24.7 mmt -60.83 -45.27 95.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.762 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.734 ' HA ' ' HB2' ' A' ' 85' ' ' MET . 0.2 OUTLIER -74.79 -27.33 20.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.339 -0.545 . . . . 0.0 110.672 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.614 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 76.7 mtp85 -60.57 -42.56 96.92 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.609 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 55.5 m -92.85 -15.27 26.66 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.532 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.734 ' HB2' ' HA ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -70.79 -48.14 55.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.208 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -94.16 -8.16 40.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.608 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.568 ' CB ' ' O ' ' A' ' 83' ' ' ARG . 66.3 t0 -93.46 97.09 10.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.308 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.607 ' OD1' ' N ' ' A' ' 89' ' ' SER . 5.0 p30 -68.44 -38.76 81.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.567 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.607 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 22.0 t 179.06 71.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.563 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -144.33 134.35 24.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.526 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -150.65 163.82 29.72 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.626 ' O ' ' CD1' ' A' ' 138' ' ' PHE . 5.7 ptmm? -61.3 -23.77 65.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.817 0.342 . . . . 0.0 110.608 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.626 ' CD1' ' O ' ' A' ' 137' ' ' LYS . 1.1 m-85 178.57 -87.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.578 ' O ' ' O ' ' A' ' 140' ' ' ARG . 10.8 mmmm 49.86 30.44 3.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.61 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.578 ' O ' ' O ' ' A' ' 139' ' ' LYS . 8.6 ptp180 44.14 177.44 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.298 0.57 . . . . 0.0 110.951 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.608 ' O ' ' CB ' ' A' ' 142' ' ' THR . 6.3 Cg_exo -73.18 171.82 16.83 Favored 'Trans proline' 0 C--N 1.302 -1.901 0 C-N-CA 123.831 3.021 . . . . 0.0 111.48 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.608 ' CB ' ' O ' ' A' ' 141' ' ' PRO . 0.7 OUTLIER 92.31 112.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.093 0.473 . . . . 0.0 111.017 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.608 ' O ' ' N ' ' A' ' 145' ' ' ARG . 24.5 mt 36.26 63.21 0.64 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.447 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -54.91 76.82 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.956 0.408 . . . . 0.0 110.7 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.608 ' N ' ' O ' ' A' ' 143' ' ' LEU . 37.9 ttm-85 -176.49 -50.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.496 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.578 ' C ' ' O ' ' A' ' 145' ' ' ARG . 0.0 OUTLIER 18.37 52.99 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.719 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER -103.85 142.78 33.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.646 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.732 ' O ' HG23 ' A' ' 148' ' ' ILE . 20.8 tt -39.68 111.61 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.921 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.635 ' O ' ' CB ' ' A' ' 153' ' ' MET . 66.3 m -42.21 96.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.496 ' N ' ' O ' ' A' ' 148' ' ' ILE . . . -60.1 -39.1 84.99 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.326 0.391 . . . . 0.0 111.225 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.555 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 40.9 m-20 -50.88 -77.53 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.508 0.67 . . . . 0.0 110.811 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.6 -35.92 81.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.199 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.652 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 9.6 ttt -48.49 -53.78 16.73 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.382 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.845 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 2.0 mtp -65.93 -34.0 77.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.09 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.555 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 75.7 mt-30 -59.28 -43.28 92.53 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.62 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . 0.441 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.32 -43.97 96.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -63.66 -41.02 98.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.482 -179.156 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.566 HD21 ' HB3' ' A' ' 22' ' ' ALA . 92.4 mt -88.24 -5.99 58.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.545 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 62.37 36.36 92.99 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 75.79 76.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 110.546 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.714 ' O ' ' HB2' ' A' ' 162' ' ' ALA . 75.7 ttt180 -104.31 90.4 3.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.577 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.714 ' HB2' ' O ' ' A' ' 161' ' ' ARG . . . 149.86 57.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.494 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 16.0 mttp 61.22 -157.53 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.69 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.4 -149.75 44.23 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -41.52 155.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.753 0.311 . . . . 0.0 110.176 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.532 ' O ' ' CD2' ' A' ' 167' ' ' HIS . 71.8 m80 -60.8 -38.2 84.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.088 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . 0.596 ' CD2' ' O ' ' A' ' 159' ' ' GLY . 0.2 OUTLIER 171.52 -94.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.389 179.6 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 31.5 p80 -158.71 163.18 37.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.513 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . 0.552 ' ND1' ' O ' ' A' ' 170' ' ' HIS . 59.6 t-80 -133.49 129.04 36.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.583 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . 0.552 ' O ' ' ND1' ' A' ' 169' ' ' HIS . 96.4 m-70 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.596 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.5 ' C7 ' HD11 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.547 ' CE ' HG21 ' A' ' 79' ' ' VAL . 28.8 mtp . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -66.99 108.65 2.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.092 0.473 . . . . 0.0 110.533 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.525 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 70.3 m-20 -61.54 -40.15 93.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.166 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.629 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -55.07 -48.28 76.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.293 0.568 . . . . 0.0 109.855 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.656 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 21.6 m-30 -71.01 -29.05 64.89 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.616 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 1.4 mmpt? -58.93 -43.79 91.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.551 0.691 . . . . 0.0 109.282 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.63 -34.17 77.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.157 177.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.95 -41.41 82.77 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.611 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.675 HG13 ' HG ' ' A' ' 78' ' ' LEU . 72.2 t -62.24 -45.76 98.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.119 0.485 . . . . 0.0 109.705 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -70.06 -23.07 63.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.642 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.44 -33.74 67.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.536 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.587 HD12 HD11 ' A' ' 78' ' ' LEU . 13.9 mt -62.46 129.42 40.56 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.334 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.761 HG23 ' H ' ' A' ' 16' ' ' GLN . 2.6 t -69.64 -179.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.193 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 79.0 mm-40 -60.85 -45.03 96.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.138 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.85 -49.63 56.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.952 0.406 . . . . 0.0 111.454 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.761 ' H ' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -57.43 -51.31 69.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.273 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.65 -35.28 79.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.883 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.552 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.9 t-20 -60.04 -43.36 95.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.111 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.497 ' O ' ' CE ' ' A' ' 154' ' ' MET . 17.0 mt-10 -60.0 -51.06 71.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.084 0.468 . . . . 0.0 110.353 179.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.667 ' CD2' ' SD ' ' A' ' 154' ' ' MET . 42.2 m-85 -62.69 -36.2 82.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.751 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.62 -41.3 85.6 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.767 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.67 -42.29 96.78 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.845 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.702 ' HB1' HD12 ' A' ' 157' ' ' LEU . . . -61.76 -39.14 90.58 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.041 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.762 ' O ' HG22 ' A' ' 28' ' ' VAL . 10.0 t80 -55.9 -49.75 72.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.391 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.419 ' O ' ' N ' ' A' ' 29' ' ' LEU . 38.7 t70 -62.45 -41.42 98.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.603 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.767 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -59.96 -42.45 89.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.291 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 1.102 ' CE1' HD11 ' A' ' 157' ' ' LEU . 5.6 m-85 -61.08 -39.42 89.85 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.33 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.762 HG22 ' O ' ' A' ' 24' ' ' PHE . 6.8 m -105.18 24.6 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.597 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -54.72 105.85 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.151 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.03 3.16 59.13 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.549 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -69.37 134.48 49.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 110.46 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -67.84 -42.03 82.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.526 ' O ' ' OD1' ' A' ' 33' ' ' ASP . 67.5 t0 -92.13 -20.83 20.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.389 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.703 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 88.48 -8.3 79.34 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.586 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.8 p -78.13 137.08 38.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.359 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.764 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.9 mt -75.82 107.86 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.893 0.378 . . . . 0.0 111.189 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.616 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 24.3 p -101.28 175.19 5.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.828 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.708 ' N ' HD11 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -55.66 -35.79 66.35 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.363 -179.393 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -71.86 -46.28 58.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.244 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.652 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . 33.1 mp0 -72.42 -20.93 61.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.826 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 45' ' ' MET . 1.1 tt -82.49 -48.97 10.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.932 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.541 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.57 -37.4 94.67 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.652 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.17 -57.53 4.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.376 -0.485 . . . . 0.0 110.121 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.718 HG11 ' CE1' ' A' ' 27' ' ' PHE . 11.3 t -62.68 -34.35 64.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.051 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 1.007 ' SD ' HD12 ' A' ' 148' ' ' ILE . 91.3 mmm -58.59 -42.34 87.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 34.9 mtp-105 -66.57 -33.28 75.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 109.776 177.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.492 ' HB2' ' O ' ' A' ' 44' ' ' VAL . 16.4 mtm -59.74 -37.08 77.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.865 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.819 HD21 ' HB3' ' A' ' 156' ' ' ALA . 69.7 mt -87.06 0.05 55.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.63 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.75 7.69 52.93 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.179 -0.769 . . . . 0.0 111.179 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.666 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 23.1 mm100 -96.06 131.94 41.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.762 0.315 . . . . 0.0 110.831 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.464 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 40.2 t-20 -127.87 60.6 46.64 Favored Pre-proline 0 C--N 1.324 -0.542 0 C-N-CA 120.109 -0.636 . . . . 0.0 110.943 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.761 ' HG2' HD21 ' A' ' 57' ' ' LEU . 59.7 Cg_endo -76.72 138.35 18.93 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 C-N-CA 122.615 2.21 . . . . 0.0 112.355 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.1 p -72.06 154.06 92.5 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 121.138 0.494 . . . . 0.0 110.502 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.98 -35.65 90.43 Favored 'Trans proline' 0 C--N 1.3 -1.996 0 C-N-CA 122.836 2.357 . . . . 0.0 111.705 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -61.88 -41.18 97.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.329 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.417 ' HB3' ' HE1' ' A' ' 60' ' ' MET . 2.8 mt-10 -81.26 -37.25 28.81 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.086 0.469 . . . . 0.0 110.418 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.761 HD21 ' HG2' ' A' ' 52' ' ' PRO . 52.4 mt -61.86 -31.24 71.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.525 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.529 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 46.5 tt0 -59.43 -42.33 91.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.989 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -67.0 -43.12 83.74 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.266 0.555 . . . . 0.0 110.557 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.528 ' HG2' ' S1 ' ' A' ' 201' ' ' V8Y . 3.4 mpp? -60.29 -38.52 83.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.34 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.708 HD11 ' N ' ' A' ' 38' ' ' THR . 1.1 mt -61.93 -46.83 95.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.024 0.44 . . . . 0.0 110.389 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.557 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 60.2 t0 -56.45 -26.7 54.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.396 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.544 ' O ' ' NH1' ' A' ' 83' ' ' ARG . 8.9 tp10 -45.77 -37.65 6.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.068 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.866 HG21 ' SD ' ' A' ' 80' ' ' MET . 0.2 OUTLIER -119.96 -13.77 8.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.741 179.555 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.544 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 29.2 t70 -86.39 68.12 10.12 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.521 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.516 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 86.7 tt0 -68.02 -17.17 64.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.67 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -12.66 60.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.62 -178.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.89 2.51 82.09 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.3 p -65.7 -18.24 65.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.838 0.351 . . . . 0.0 110.748 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.523 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 75.0 13.37 82.73 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.586 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.5 p -138.94 130.86 27.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.03 0.443 . . . . 0.0 110.802 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.764 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -96.45 112.8 29.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.917 179.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 14.0 p-10 -82.11 -165.83 1.1 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.371 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 1.017 ' HE1' HD23 ' A' ' 78' ' ' LEU . 2.1 t80 -57.08 -49.75 74.89 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.711 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -64.51 -44.22 91.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.778 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.497 ' OE1' ' HA ' ' A' ' 65' ' ' ASP . 54.8 mt-10 -64.9 -41.61 95.46 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.211 0.529 . . . . 0.0 110.477 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.703 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.53 -40.53 85.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.924 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.017 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -58.37 -38.95 78.3 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.719 HG12 ' HG3' ' A' ' 83' ' ' ARG . 47.1 t -61.57 -40.01 85.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.895 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.866 ' SD ' HG21 ' A' ' 64' ' ' VAL . 32.4 mtm -58.36 -39.97 80.99 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.559 ' O ' ' HG3' ' A' ' 85' ' ' MET . 23.8 mmt -61.35 -43.86 98.15 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.011 0.434 . . . . 0.0 110.583 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.755 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 0.2 OUTLIER -76.27 -30.8 20.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.363 179.354 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.719 ' HG3' HG12 ' A' ' 79' ' ' VAL . 25.9 mtp180 -60.01 -44.6 94.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.12 0.486 . . . . 0.0 110.045 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 70.8 m -69.61 -39.82 77.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.531 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.755 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 74.1 mtm -61.9 -40.82 96.77 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.477 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.569 ' O ' ' O ' ' A' ' 87' ' ' ASP . 12.3 tptt -62.97 -42.64 99.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.156 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.569 ' O ' ' O ' ' A' ' 86' ' ' LYS . 62.1 t0 54.36 127.63 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.668 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.18 -41.24 96.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.701 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 75.7 m -63.08 -40.04 96.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.453 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 89' ' ' SER . 0.0 OUTLIER 71.38 -93.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.321 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -146.57 7.51 1.3 Allowed Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -72.09 149.41 44.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.783 0.325 . . . . 0.0 110.94 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -90.42 107.04 18.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.62 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.532 ' HE2' ' O ' ' A' ' 139' ' ' LYS . 0.0 OUTLIER -178.9 59.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.769 179.92 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.523 ' HB3' ' HD2' ' A' ' 141' ' ' PRO . 63.3 mtm180 -151.41 168.96 10.1 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.91 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.58 ' O ' ' OG1' ' A' ' 142' ' ' THR . 21.5 Cg_exo -64.69 -45.81 8.02 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 123.029 2.486 . . . . 0.0 112.319 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.58 ' OG1' ' O ' ' A' ' 141' ' ' PRO . 0.7 OUTLIER -175.57 -137.9 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.591 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 76.2 mt -102.32 10.37 39.2 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.657 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -64.71 141.23 58.85 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.577 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.441 ' HD3' ' H ' ' A' ' 145' ' ' ARG . 0.0 OUTLIER -149.68 148.71 29.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.446 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 147' ' ' ARG . 23.2 t -129.8 -33.4 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.102 0.477 . . . . 0.0 110.226 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.643 ' O ' ' C ' ' A' ' 148' ' ' ILE . 0.0 OUTLIER -38.74 106.94 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.086 -179.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 1.007 HD12 ' SD ' ' A' ' 45' ' ' MET . 21.1 tt -12.41 84.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.579 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.622 ' O ' ' CB ' ' A' ' 153' ' ' MET . 45.0 t -36.41 107.97 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.925 -179.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.2 87.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.879 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.526 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 65.3 m-20 -55.43 -71.31 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.41 0.624 . . . . 0.0 110.669 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.498 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -62.31 -34.52 76.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.758 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.785 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 6.2 ttt -50.87 -48.92 60.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.449 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.667 ' SD ' ' CD2' ' A' ' 20' ' ' PHE . 1.8 mtp -70.75 -27.89 64.28 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.285 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 86.4 mt-30 -59.37 -45.67 90.8 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.156 -178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . 0.819 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -75.98 -29.32 58.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.253 178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 1.102 HD11 ' CE1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -60.27 -40.18 89.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.689 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.577 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 65.9 mt -86.02 -8.5 57.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.988 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.613 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 71.44 30.68 66.5 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 75.57 40.73 0.29 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.792 0.33 . . . . 0.0 110.487 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.577 ' HB2' ' HB3' ' A' ' 158' ' ' LEU . 0.1 OUTLIER -59.2 -73.81 0.08 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.753 -179.793 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -162.88 -178.31 6.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.665 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -118.79 -137.0 0.34 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.668 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -79.87 -161.31 22.94 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.768 -0.933 . . . . 0.0 110.768 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -72.59 -15.42 61.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.812 0.339 . . . . 0.0 110.385 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.91 -88.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.617 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . 0.491 ' HB3' ' O ' ' A' ' 170' ' ' HIS . 97.4 m-70 -116.88 19.15 14.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.561 ' CG ' ' H ' ' A' ' 169' ' ' HIS . 21.2 t-160 47.48 -123.99 1.56 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.531 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . 0.561 ' H ' ' CG ' ' A' ' 168' ' ' HIS . 54.4 p-80 -96.6 -9.28 29.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.805 0.335 . . . . 0.0 110.624 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . 0.5 ' ND1' ' CE1' ' A' ' 169' ' ' HIS . 46.9 p-80 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.802 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.528 ' S1 ' ' HG2' ' A' ' 60' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.821 ' CE ' HG21 ' A' ' 79' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -92.22 114.28 26.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.222 0.534 . . . . 0.0 110.717 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -63.32 -39.12 93.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.437 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.579 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -54.24 -47.06 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 121.429 0.633 . . . . 0.0 109.527 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.658 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 22.5 m-30 -71.05 -31.8 68.34 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.373 0.606 . . . . 0.0 109.584 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -57.17 -45.03 84.03 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.017 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -63.98 -35.89 82.18 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.177 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -56.48 -40.38 74.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.641 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.744 HG13 ' HG ' ' A' ' 78' ' ' LEU . 79.7 t -62.07 -46.59 96.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.69 -24.35 63.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.628 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 23.5 mm100 -70.38 -36.94 74.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.635 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.872 HD12 HD11 ' A' ' 78' ' ' LEU . 23.4 mt -59.9 110.35 1.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.498 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.712 HG23 ' H ' ' A' ' 16' ' ' GLN . 5.0 t -53.92 177.88 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.186 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 24.0 pt-20 -56.98 -37.48 71.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.694 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 79.3 tt0 -75.4 -46.93 29.86 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.197 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.712 ' H ' HG23 ' A' ' 13' ' ' THR . 11.3 mt-30 -59.85 -48.51 81.39 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.794 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.462 ' CG ' ' HZ ' ' A' ' 74' ' ' PHE . 26.1 ttmt -65.6 -33.36 75.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.558 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 66.6 t30 -60.55 -43.44 97.21 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.292 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.544 ' O ' ' HE3' ' A' ' 154' ' ' MET . 1.1 tt0 -62.05 -51.78 66.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.408 0.623 . . . . 0.0 109.905 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.679 ' CD1' HD13 ' A' ' 12' ' ' LEU . 68.7 m-85 -65.31 -37.76 88.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.053 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -58.01 -40.8 81.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.737 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 1.046 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -61.01 -41.83 97.29 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.99 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -60.05 -38.6 83.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.052 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.861 ' O ' HG22 ' A' ' 28' ' ' VAL . 41.6 t80 -57.37 -48.83 78.02 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.553 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 29' ' ' LEU . 67.0 t0 -61.55 -41.3 97.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.312 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 1.046 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -59.54 -45.38 93.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.535 179.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.751 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 16.0 m-85 -61.13 -40.54 94.18 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.353 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.861 HG22 ' O ' ' A' ' 24' ' ' PHE . 15.0 m -104.27 23.82 2.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.419 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.613 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -52.67 106.3 0.15 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 -179.61 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.34 7.01 67.9 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.539 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -65.52 135.59 55.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.743 0.306 . . . . 0.0 110.389 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.99 -41.39 95.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.175 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.3 p30 -96.91 -19.6 18.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.845 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.631 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 86.97 -8.62 75.57 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.6 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 54.6 p -80.91 136.42 36.05 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.745 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.5 mt -72.94 104.75 2.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.834 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.625 ' HB3' HG22 ' A' ' 71' ' ' THR . 87.2 p -99.79 159.96 14.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.549 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.751 ' N ' HD11 ' A' ' 61' ' ' ILE . 1.3 p -41.57 -32.59 0.37 Allowed 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.35 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -74.73 -43.42 55.09 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.172 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.653 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . 4.8 mm-40 -74.49 -21.97 59.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.344 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.601 HD22 HD22 ' A' ' 57' ' ' LEU . 3.4 tt -83.32 -50.15 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.839 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.529 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.48 -37.13 94.18 Favored Glycine 0 CA--C 1.536 1.366 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.653 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 0.3 OUTLIER -46.4 -59.89 2.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 117.236 0.518 . . . . 0.0 109.986 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.751 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 9.6 t -62.03 -34.09 61.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 1.02 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.5 mmm -58.5 -43.31 89.02 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.009 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.618 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 21.7 mtt180 -67.24 -32.48 73.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.192 0.52 . . . . 0.0 109.73 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.616 ' HE1' HG22 ' A' ' 44' ' ' VAL . 26.0 mtm -60.79 -37.18 81.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.063 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.678 HD13 ' HA ' ' A' ' 153' ' ' MET . 57.3 mt -89.79 3.84 51.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.537 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.6 -3.62 57.74 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.618 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 8.2 mm100 -85.31 129.52 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.787 0.327 . . . . 0.0 111.137 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -129.19 61.44 57.14 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.906 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.748 ' CG ' HD21 ' A' ' 57' ' ' LEU . 58.7 Cg_endo -73.8 143.86 34.07 Favored 'Trans proline' 0 C--N 1.299 -2.048 0 C-N-CA 122.542 2.161 . . . . 0.0 112.29 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.4 p -73.63 156.98 88.19 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 121.202 0.525 . . . . 0.0 110.551 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.85 -40.24 73.98 Favored 'Trans proline' 0 C--N 1.299 -2.059 0 C-N-CA 122.791 2.327 . . . . 0.0 112.017 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 52.5 mp0 -62.69 -40.4 97.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.391 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 60' ' ' MET . 1.6 tp10 -78.52 -37.77 42.27 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.44 0.638 . . . . 0.0 109.788 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.748 HD21 ' CG ' ' A' ' 52' ' ' PRO . 33.0 mt -61.05 -35.65 77.48 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.476 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -41.77 88.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.403 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -63.47 -41.67 98.59 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 110.028 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.502 ' HG2' ' HA ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -65.14 -40.99 95.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.751 HD11 ' N ' ' A' ' 38' ' ' THR . 2.6 mt -61.61 -47.09 94.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.803 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.628 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 39.1 t70 -60.28 -29.37 68.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.719 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -54.23 -38.18 65.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.208 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.829 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 2.2 m -110.51 0.86 9.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.044 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.628 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 57.3 t0 -85.2 109.21 18.15 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.128 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.48 -49.09 72.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.982 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.555 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 51.8 p30 -89.34 -6.18 56.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.755 0.312 . . . . 0.0 110.673 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.447 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 65.66 27.04 72.25 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.615 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.1 p -68.52 4.22 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.858 0.361 . . . . 0.0 110.73 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.55 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.77 16.08 80.48 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.556 -1.017 . . . . 0.0 110.556 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.625 HG22 ' HB3' ' A' ' 37' ' ' SER . 4.6 p -141.31 128.91 21.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.745 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -98.95 103.91 15.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.448 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.59 ' OD1' ' CB ' ' A' ' 35' ' ' SER . 66.4 m-20 -74.58 -164.96 0.31 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.39 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 1.001 ' HE1' HD23 ' A' ' 78' ' ' LEU . 4.4 t80 -57.21 -48.48 78.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.63 -48.39 75.05 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.784 0.326 . . . . 0.0 110.823 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.615 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 52.5 mt-10 -62.36 -41.68 98.8 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.289 0.566 . . . . 0.0 110.463 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.731 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.51 -41.15 84.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.057 0.456 . . . . 0.0 109.823 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.001 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -56.07 -40.65 73.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.595 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.821 HG21 ' CE ' ' A' ' 1' ' ' MET . 43.9 t -61.08 -42.62 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.882 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.509 ' HB2' HG11 ' A' ' 64' ' ' VAL . 4.3 ttm -52.22 -44.77 64.99 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.666 ' O ' ' SD ' ' A' ' 85' ' ' MET . 33.6 mmt -60.28 -46.3 90.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.998 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.7 ' HA ' ' HE2' ' A' ' 85' ' ' MET . 0.2 OUTLIER -74.83 -26.87 19.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.653 179.511 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.658 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 83.4 mtt-85 -60.16 -44.79 94.72 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.984 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.579 ' O ' ' N ' ' A' ' 88' ' ' ASP . 79.4 p -92.74 -17.58 24.03 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.483 179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.7 ' HE2' ' HA ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -66.27 -46.06 78.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -60.93 -43.33 98.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.212 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.478 ' OD1' ' HA ' ' A' ' 84' ' ' SER . 54.4 p30 -104.94 18.1 22.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.38 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.579 ' N ' ' O ' ' A' ' 84' ' ' SER . 65.3 t0 -59.05 -46.15 88.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.46 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.636 ' O ' ' C ' ' A' ' 90' ' ' LYS . 69.6 m 43.13 26.45 0.09 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.596 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.636 ' C ' ' O ' ' A' ' 89' ' ' SER . 5.4 ptmt -0.53 -111.24 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.737 0.648 . . . . 0.0 110.864 -179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 81.97 174.16 49.3 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.68 -67.63 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.794 0.331 . . . . 0.0 110.398 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -123.89 -15.3 6.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.665 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -102.74 -17.21 15.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.945 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.56 ' HB3' ' HD2' ' A' ' 141' ' ' PRO . 0.7 OUTLIER -116.6 175.25 2.03 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.826 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.56 ' HD2' ' HB3' ' A' ' 140' ' ' ARG . 32.9 Cg_exo -60.54 149.66 85.66 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 123.377 2.718 . . . . 0.0 112.369 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.627 HG23 ' N ' ' A' ' 143' ' ' LEU . 6.4 t -70.91 -129.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.318 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.627 ' N ' HG23 ' A' ' 142' ' ' THR . 42.1 mt 84.67 173.03 0.07 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.876 0.369 . . . . 0.0 110.578 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -83.81 -111.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.259 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 51.06 41.39 27.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.518 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.416 ' O ' ' O ' ' A' ' 147' ' ' ARG . 21.2 t -87.26 -47.92 15.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.565 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.416 ' O ' ' O ' ' A' ' 146' ' ' VAL . 2.4 mpt_? 41.8 -164.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.406 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 1.02 HD12 ' SD ' ' A' ' 45' ' ' MET . 19.3 tt -70.4 76.72 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.195 0.521 . . . . 0.0 110.366 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.578 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.3 OUTLIER -34.54 107.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.278 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.471 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.73 -39.19 83.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -43.28 -84.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.346 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.435 ' HA ' ' HB2' ' A' ' 155' ' ' GLN . . . -61.19 -33.91 74.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.226 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.679 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 6.3 ttt -48.22 -49.78 31.78 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.288 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.99 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 3.6 mtp -76.42 -27.04 56.13 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.534 179.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 76.0 mt-30 -60.37 -43.19 96.81 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.338 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . 0.627 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -64.1 -44.68 91.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.024 0.44 . . . . 0.0 110.682 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.633 ' N ' HD23 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -62.46 -43.17 99.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.582 -179.287 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.729 HD21 ' HB3' ' A' ' 22' ' ' ALA . 90.1 mt -82.57 -13.58 56.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.231 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.637 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 59.04 31.12 68.0 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 76.5 -6.48 2.0 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.654 0.264 . . . . 0.0 110.681 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.59 ' O ' ' O ' ' A' ' 162' ' ' ALA . 6.7 ptm180 27.76 36.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.755 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.623 ' N ' ' O ' ' A' ' 160' ' ' ALA . . . 51.42 121.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.928 0.394 . . . . 0.0 110.497 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -59.42 127.01 29.96 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.509 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . 0.537 ' O ' ' CB ' ' A' ' 165' ' ' HIS . . . -82.41 165.41 44.62 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.537 ' CB ' ' O ' ' A' ' 164' ' ' GLY . 0.1 OUTLIER 158.82 -67.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.802 0.335 . . . . 0.0 110.702 179.659 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -153.32 160.55 42.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.734 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -159.8 162.27 34.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.818 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -150.24 -156.38 0.71 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.552 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -59.62 -9.34 2.55 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.416 -179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.566 -179.941 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.829 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.558 ' O ' ' O ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.558 ' O ' ' O ' ' A' ' 1' ' ' MET . 4.5 m-20 40.7 101.74 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.98 0.419 . . . . 0.0 110.592 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 97.0 m-20 -60.36 -38.43 83.82 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.582 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -53.37 -46.67 58.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.271 -0.571 . . . . 0.0 109.651 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.6 m-30 -71.29 -29.69 65.36 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.73 -45.73 88.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.07 -34.56 78.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.288 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -58.12 -40.83 82.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.847 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.873 HG22 HD12 ' A' ' 78' ' ' LEU . 94.0 t -62.87 -45.52 98.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -69.94 -26.98 64.39 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.412 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 12.1 mm100 -69.57 -37.9 77.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.588 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.738 HD12 HD11 ' A' ' 78' ' ' LEU . 20.2 mt -56.36 128.49 36.16 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.281 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.727 HG23 ' H ' ' A' ' 16' ' ' GLN . 9.0 t -63.65 179.4 0.48 Allowed 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.092 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -61.4 -41.1 96.6 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.464 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -69.93 -42.12 73.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.84 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.727 ' H ' HG23 ' A' ' 13' ' ' THR . 71.4 mt-30 -61.89 -43.5 98.72 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 5.8 mtmt -71.96 -30.18 65.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.813 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -62.2 -49.05 77.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.227 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.583 ' O ' ' CE ' ' A' ' 154' ' ' MET . 64.4 mt-10 -63.14 -44.72 94.77 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.418 0.627 . . . . 0.0 110.37 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.65 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 39.0 m-85 -67.74 -37.07 81.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.674 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 29.1 tptp -60.78 -40.32 92.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.846 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 1.04 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.01 -42.97 95.45 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.76 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.851 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.07 -39.62 90.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.825 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.654 ' O ' HG22 ' A' ' 28' ' ' VAL . 16.3 t80 -56.65 -48.8 76.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.645 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 29' ' ' LEU . 6.3 t70 -61.72 -41.67 97.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.827 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 1.04 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.26 -44.46 83.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.667 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.984 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 21.3 m-85 -61.92 -40.96 97.27 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.342 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.693 HG13 HG12 ' A' ' 36' ' ' ILE . 31.4 m -106.46 25.38 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.458 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.764 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -54.0 111.17 0.7 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.253 -179.519 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.84 3.06 83.67 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.511 ' CB ' ' HB ' ' A' ' 28' ' ' VAL . . . -62.66 136.6 57.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.353 . . . . 0.0 110.301 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 61.9 mp0 -64.81 -40.31 94.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.459 ' OD1' ' HB3' ' A' ' 35' ' ' SER . 11.0 t70 -96.98 -22.81 16.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.741 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.646 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 89.07 -8.85 78.88 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.592 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 81.4 p -79.69 136.46 36.79 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.759 ' HB ' HG13 ' A' ' 72' ' ' VAL . 94.6 mt -73.77 104.15 2.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.551 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 83.5 p -97.01 168.09 10.67 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.073 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.777 HG22 ' HB3' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -49.16 -38.21 24.83 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.552 -179.471 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.45 -49.17 57.53 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.133 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.551 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 1.4 mp0 -64.51 -43.83 92.83 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.07 0.462 . . . . 0.0 110.743 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.726 HD22 ' HE1' ' A' ' 60' ' ' MET . 4.0 tt -64.98 -49.81 68.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.133 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.58 -31.83 79.17 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.118 -1.193 . . . . 0.0 110.118 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.519 ' HE3' ' O ' ' A' ' 26' ' ' ILE . 0.0 OUTLIER -54.33 -54.05 45.56 Favored 'General case' 0 C--O 1.23 0.055 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.538 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 1.032 HG22 ' SD ' ' A' ' 47' ' ' MET . 1.1 t -66.1 -32.22 57.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.975 ' SD ' HD12 ' A' ' 148' ' ' ILE . 89.5 mmm -59.18 -43.38 92.19 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 78.5 mtp85 -66.98 -37.85 84.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.703 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 1.032 ' SD ' HG22 ' A' ' 44' ' ' VAL . 1.3 ptm -55.08 -29.15 56.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.488 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 148' ' ' ILE . 32.0 mt -94.79 0.02 54.56 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.808 -179.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.42 5.64 54.02 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.708 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 14.8 mm100 -88.86 135.68 33.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.926 0.393 . . . . 0.0 111.242 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.53 ' ND2' HH12 ' A' ' 46' ' ' ARG . 51.4 t-20 -128.67 60.45 49.25 Favored Pre-proline 0 C--N 1.32 -0.705 0 C-N-CA 119.474 -0.891 . . . . 0.0 111.089 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.765 ' HG2' HD11 ' A' ' 57' ' ' LEU . 71.6 Cg_endo -77.05 144.69 24.04 Favored 'Trans proline' 0 C--N 1.302 -1.871 0 C-N-CA 122.659 2.239 . . . . 0.0 112.471 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 p -80.68 153.53 73.2 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.101 0.477 . . . . 0.0 110.458 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.31 -36.69 94.19 Favored 'Trans proline' 0 C--N 1.3 -2.0 0 C-N-CA 122.792 2.328 . . . . 0.0 111.978 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.4 mp0 -62.45 -39.87 94.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.433 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -81.96 -34.42 29.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.908 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.777 ' HB3' HG22 ' A' ' 38' ' ' THR . 32.6 mt -64.93 -39.24 93.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.851 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.501 ' N ' ' CG2' ' A' ' 38' ' ' THR . 7.1 mt-30 -53.53 -50.18 66.02 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.839 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -62.92 -44.05 97.12 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.582 0.706 . . . . 0.0 109.953 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.726 ' HE1' HD22 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -58.52 -42.91 88.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.134 179.104 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.732 HD11 ' N ' ' A' ' 38' ' ' THR . 3.2 mt -60.61 -47.72 91.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.971 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.649 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 18.7 t70 -56.54 -22.31 32.27 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.578 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' MET . 51.6 tp10 -49.97 -39.54 41.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.761 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 0.8 OUTLIER -115.1 -4.97 11.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.911 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.649 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 53.4 t0 -72.04 114.81 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.602 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -64.63 -46.5 82.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.58 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 59.5 p30 -94.06 -6.27 45.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.868 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 70' ' ' GLY . . . 68.12 23.1 74.61 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.612 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 1.4 p -69.61 5.72 1.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.836 0.35 . . . . 0.0 110.699 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.683 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 74.68 17.52 80.0 Favored Glycine 0 CA--C 1.518 0.257 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.592 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 1.1 p -138.71 122.37 17.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.922 0.392 . . . . 0.0 111.106 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.759 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -99.97 106.19 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.195 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.7 m-20 -73.62 -166.79 0.39 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.507 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.979 ' HE1' HD23 ' A' ' 78' ' ' LEU . 0.8 OUTLIER -57.85 -51.09 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.248 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -63.14 -43.51 98.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.859 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.635 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 68.6 mt-10 -64.62 -39.04 93.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.672 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -72.35 -39.18 68.3 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.198 0.523 . . . . 0.0 110.279 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.979 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.7 -36.58 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -179.352 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.637 ' O ' HG13 ' A' ' 82' ' ' VAL . 48.8 t -59.95 -40.43 82.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.315 0.578 . . . . 0.0 109.732 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.425 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 9.5 ttt -57.2 -43.09 82.4 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.857 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.692 ' O ' ' SD ' ' A' ' 85' ' ' MET . 38.8 mmt -60.19 -47.5 85.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.113 0.482 . . . . 0.0 110.547 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.657 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER -69.77 -31.05 47.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.377 179.231 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.642 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 90.6 mtt-85 -59.22 -39.84 83.95 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.216 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.7 p -85.0 -20.7 30.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.647 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.692 ' SD ' ' O ' ' A' ' 81' ' ' MET . 0.2 OUTLIER -66.3 -40.41 89.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.762 179.435 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -62.67 -42.57 99.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.489 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -61.23 -46.39 90.6 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.962 -179.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.611 ' OD1' ' N ' ' A' ' 89' ' ' SER . 22.1 p30 -73.1 -20.74 60.88 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.862 0.363 . . . . 0.0 110.5 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.611 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 2.1 t 52.42 -81.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.795 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' A' ' 88' ' ' ASP . 1.9 ptmt -83.65 24.5 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.808 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -102.18 101.1 2.11 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.483 ' O ' ' CD1' ' A' ' 138' ' ' PHE . 18.9 mtpp -95.49 -51.14 4.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 0.0 110.435 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.483 ' CD1' ' O ' ' A' ' 137' ' ' LYS . 0.2 OUTLIER 164.78 20.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.763 179.862 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 140' ' ' ARG . 5.6 mmmt -59.89 -159.54 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.594 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.492 ' HD3' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -63.61 169.84 3.71 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.209 0.528 . . . . 0.0 110.095 -179.705 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.492 ' HD2' ' HD3' ' A' ' 140' ' ' ARG . 19.3 Cg_exo -64.4 107.77 0.89 Allowed 'Trans proline' 0 C--N 1.301 -1.954 0 C-N-CA 122.968 2.446 . . . . 0.0 111.422 -178.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.5 m -86.19 -132.52 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.441 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 86.3 mt -83.48 137.73 33.76 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.369 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 8.0 ptp180 -72.85 143.09 47.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.601 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 6.7 mtm180 -120.36 156.95 30.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.716 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 28.0 m -60.85 -24.56 32.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.546 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -75.18 149.79 38.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.688 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.975 HD12 ' SD ' ' A' ' 45' ' ' MET . 15.9 tt -45.4 103.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.346 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.504 ' O ' ' CB ' ' A' ' 153' ' ' MET . 0.7 OUTLIER -38.49 102.38 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.249 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.473 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.66 -39.64 89.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.725 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 3.5 t0 -45.89 -79.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.134 0.492 . . . . 0.0 110.659 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.53 77.36 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.762 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.599 ' O ' ' HG ' ' A' ' 157' ' ' LEU . 11.0 ttt -48.0 -51.6 23.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.323 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.851 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.6 mtp -70.44 -30.16 66.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.363 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 21.9 mt-30 -60.8 -42.54 97.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.022 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . 0.448 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -64.02 -43.79 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.486 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.806 HD22 HG21 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -66.49 -42.79 86.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.675 -179.32 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.502 HD21 ' HB3' ' A' ' 22' ' ' ALA . 75.1 mt -79.43 -8.05 58.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.194 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 61.54 31.23 76.93 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 67.12 26.73 8.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.905 0.383 . . . . 0.0 110.507 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 158' ' ' LEU . 14.8 mtm180 -62.08 117.75 6.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.934 0.397 . . . . 0.0 110.525 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . 54.05 17.69 1.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.609 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 4.0 mptt -139.03 111.54 7.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.375 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . 0.441 ' O ' ' CB ' ' A' ' 165' ' ' HIS . . . 106.67 156.41 21.03 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.441 ' CB ' ' O ' ' A' ' 164' ' ' GLY . 0.0 OUTLIER 165.82 -29.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 0.0 110.499 -179.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.575 ' O ' ' O ' ' A' ' 167' ' ' HIS . 56.2 p-80 -67.39 -175.44 0.49 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.447 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . 0.575 ' O ' ' O ' ' A' ' 166' ' ' HIS . 1.9 t-160 -27.51 148.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.317 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -51.3 142.34 13.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.269 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . 0.568 ' O ' ' HB2' ' A' ' 170' ' ' HIS . 32.8 p80 -78.39 2.32 19.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.75 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . 0.568 ' HB2' ' O ' ' A' ' 169' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.546 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.761 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.565 ' HG3' ' CB ' ' A' ' 66' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.411 ' O ' ' O ' ' A' ' 1' ' ' MET . 80.3 m-20 44.09 93.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.474 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.85 -40.77 76.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.33 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.597 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -52.45 -47.18 47.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.422 0.63 . . . . 0.0 110.098 179.273 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.692 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 22.9 m-30 -70.3 -32.04 69.64 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -44.02 85.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 121.491 0.662 . . . . 0.0 109.223 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.78 76.73 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.255 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.86 -40.33 79.92 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.867 HG13 ' HG ' ' A' ' 78' ' ' LEU . 83.8 t -62.84 -45.36 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.42 -23.81 62.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.395 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.38 -34.63 70.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.842 -179.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.782 HD13 ' CE1' ' A' ' 20' ' ' PHE . 15.7 mt -61.55 123.99 19.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.575 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.648 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -60.88 -179.14 0.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.659 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.534 ' N ' ' OG1' ' A' ' 13' ' ' THR . 49.3 tp10 -60.34 -48.37 82.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.892 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -65.69 -43.25 89.79 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.012 0.434 . . . . 0.0 110.847 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.648 ' H ' HG23 ' A' ' 13' ' ' THR . 4.6 mt-30 -58.17 -50.83 72.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.748 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HD3' ' HZ ' ' A' ' 74' ' ' PHE . 21.3 ttmt -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.955 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -61.11 -46.32 91.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.082 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.478 ' O ' ' HE3' ' A' ' 154' ' ' MET . 0.4 OUTLIER -64.64 -46.08 84.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.487 0.661 . . . . 0.0 110.168 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.782 ' CE1' HD13 ' A' ' 12' ' ' LEU . 43.8 m-85 -62.34 -37.11 84.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.735 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.414 ' NZ ' ' HB2' ' A' ' 74' ' ' PHE . 57.8 tptt -58.56 -38.89 78.81 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 1.078 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.32 -41.56 93.78 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.962 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.67 -38.71 88.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.851 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.866 ' O ' HG22 ' A' ' 28' ' ' VAL . 14.1 t80 -58.29 -49.27 77.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.768 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' A' ' 29' ' ' LEU . 57.4 t0 -61.97 -40.79 96.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 1.078 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.2 mp -57.91 -44.78 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.812 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.849 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 16.7 m-85 -63.46 -38.12 89.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.049 0.452 . . . . 0.0 110.504 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.866 HG22 ' O ' ' A' ' 24' ' ' PHE . 6.9 m -104.71 21.09 3.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.684 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.546 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -55.76 101.76 0.06 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.384 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.88 5.06 54.05 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.42 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -69.14 139.17 54.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.682 0.277 . . . . 0.0 110.62 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -66.79 -42.33 86.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.305 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.488 ' OD2' ' OG ' ' A' ' 35' ' ' SER . 56.4 p-10 -99.98 -15.49 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.861 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 89.28 -8.63 79.41 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.621 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 52.7 p -75.73 135.47 40.35 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.829 ' CG1' HG13 ' A' ' 28' ' ' VAL . 85.4 mt -74.71 106.22 4.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.612 ' H ' ' HB2' ' A' ' 40' ' ' GLU . 38.7 t -101.26 157.87 16.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.068 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.656 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -39.16 -43.53 1.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.53 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -66.11 -41.75 90.14 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 110.361 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.624 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 6.9 mp0 -75.8 -21.7 57.08 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.454 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.603 ' O ' ' HG2' ' A' ' 45' ' ' MET . 2.6 tt -83.84 -47.94 10.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.842 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.542 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -61.09 -38.99 96.49 Favored Glycine 0 CA--C 1.527 0.793 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.624 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -46.74 -57.87 4.43 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.152 0.501 . . . . 0.0 110.283 179.347 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.746 HG11 ' CE1' ' A' ' 27' ' ' PHE . 37.1 t -62.56 -35.02 68.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.056 177.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.603 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 90.5 mmm -56.53 -43.18 79.58 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.748 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 50.9 mtp180 -64.44 -35.49 81.1 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.074 176.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.512 ' HE2' ' HA ' ' A' ' 44' ' ' VAL . 19.1 mtm -60.32 -28.59 68.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.116 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.648 HD21 ' HB3' ' A' ' 156' ' ' ALA . 24.7 mt -95.81 5.56 51.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.222 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 95.73 -2.14 64.24 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.592 -1.003 . . . . 0.0 110.592 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.748 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -84.76 135.93 33.92 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 110.869 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.456 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 24.1 p30 -129.97 58.83 40.83 Favored Pre-proline 0 C--N 1.324 -0.508 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.223 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.537 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 65.8 Cg_endo -80.33 146.54 17.6 Favored 'Trans proline' 0 C--N 1.304 -1.808 0 C-N-CA 122.787 2.325 . . . . 0.0 111.926 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.6 p -80.02 153.08 74.79 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.62 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -57.23 -40.8 79.8 Favored 'Trans proline' 0 C--N 1.301 -1.93 0 C-N-CA 122.839 2.359 . . . . 0.0 112.081 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.5 mp0 -62.49 -39.32 93.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.29 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.512 ' O ' ' HE1' ' A' ' 60' ' ' MET . 0.2 OUTLIER -80.54 -34.14 35.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.42 179.65 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.586 ' HB3' HG22 ' A' ' 38' ' ' THR . 16.3 mt -62.04 -29.48 70.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.713 179.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.44 -36.4 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.46 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -62.27 -48.75 78.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.035 0.445 . . . . 0.0 110.901 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.658 ' N ' ' SD ' ' A' ' 60' ' ' MET . 2.0 mpp? -63.53 -39.48 94.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.524 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.656 HD11 ' N ' ' A' ' 38' ' ' THR . 1.5 mt -61.96 -44.74 99.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.193 0.52 . . . . 0.0 110.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.561 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.9 t70 -59.01 -35.48 73.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.587 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -51.5 -42.46 61.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.684 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.647 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 3.1 m -106.63 3.54 10.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.681 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.561 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 34.5 t70 -107.74 90.34 3.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.366 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.565 ' CB ' ' HG3' ' A' ' 1' ' ' MET . 40.5 tt0 -79.57 -19.18 50.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.37 -11.95 60.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.643 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.48 19.09 68.48 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 62.0 p -86.32 -7.9 58.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.832 0.348 . . . . 0.0 110.875 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.555 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 74.06 17.45 79.48 Favored Glycine 0 CA--C 1.526 0.734 0 N-CA-C 110.626 -0.989 . . . . 0.0 110.626 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.621 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.1 p -137.48 128.59 27.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.044 0.449 . . . . 0.0 110.613 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.806 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -97.58 105.43 17.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.503 179.649 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 2.0 m-20 -74.11 -161.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.69 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 1.034 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.7 t80 -58.79 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.874 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -63.62 -42.48 98.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.632 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.557 ' C ' HG23 ' A' ' 72' ' ' VAL . 48.0 mt-10 -66.37 -41.38 89.53 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.311 0.577 . . . . 0.0 110.577 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.784 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -67.85 -37.83 82.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.936 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.034 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -59.1 -40.68 86.06 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.692 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.591 ' O ' HG13 ' A' ' 82' ' ' VAL . 53.8 t -62.15 -39.21 83.09 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.094 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.587 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.453 ' HB3' ' O ' ' A' ' 77' ' ' PHE . 1.4 ttm -57.02 -42.99 81.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.249 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.514 ' O ' ' HE2' ' A' ' 85' ' ' MET . 22.1 mmt -60.51 -45.38 94.0 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.035 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.636 HG12 ' O ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -75.85 -27.63 18.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.494 178.768 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.692 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 3.4 mtt85 -64.87 -39.25 93.25 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.911 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.793 ' OG ' HG21 ' A' ' 146' ' ' VAL . 37.0 t -86.47 -48.24 8.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.988 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.625 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 3.6 ptp -62.64 -17.99 61.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.562 -179.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 82' ' ' VAL . 57.7 tptt -54.81 -34.62 62.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.472 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.562 ' HA ' ' HB3' ' A' ' 90' ' ' LYS . 58.9 p30 -60.17 -19.99 56.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.415 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.56 ' N ' ' OD1' ' A' ' 87' ' ' ASP . 97.9 m-20 -63.28 -40.0 96.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.645 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 61.6 p -119.04 14.53 13.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.888 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.562 ' HB3' ' HA ' ' A' ' 87' ' ' ASP . 10.0 pttp -71.25 179.2 2.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.503 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.422 ' N ' ' HG3' ' A' ' 90' ' ' LYS . . . 75.55 -167.61 54.79 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 138' ' ' PHE . 14.6 mptt 59.49 93.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.689 0.281 . . . . 0.0 110.571 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.482 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 16.9 m-85 66.84 13.58 9.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.767 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -136.78 144.85 43.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.678 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.547 ' HB2' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -74.62 171.55 11.16 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.351 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.547 ' HD2' ' HB2' ' A' ' 140' ' ' ARG . 48.2 Cg_endo -83.3 78.69 3.11 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 123.29 2.66 . . . . 0.0 112.312 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 98.2 m -59.96 -45.95 90.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.447 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 39.8 mt -142.6 71.7 1.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.6 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 144' ' ' ARG . 7.7 ptm180 -59.18 128.57 37.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? 61.2 156.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.372 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.793 HG21 ' OG ' ' A' ' 84' ' ' SER . 10.4 p -141.97 152.21 18.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.693 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -95.2 -46.01 6.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.644 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.601 HG22 ' O ' ' A' ' 148' ' ' ILE . 0.1 OUTLIER -78.19 118.41 25.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.483 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.62 ' O ' ' CB ' ' A' ' 153' ' ' MET . 12.5 m -87.95 102.2 14.5 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -52.48 -34.99 51.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.413 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 16.2 t0 -56.79 -80.07 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.231 0.539 . . . . 0.0 110.456 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.554 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -61.57 -34.36 75.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.849 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 4.9 ttt -45.64 -61.45 1.7 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.073 0.463 . . . . 0.0 110.252 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.962 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 6.5 mtp -63.91 -28.19 69.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.185 178.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 72.8 mt-30 -60.75 -40.64 93.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.194 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . 0.648 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -65.0 -39.92 94.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.392 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.768 ' CB ' HD13 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -73.89 -46.47 44.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.583 -179.494 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 154' ' ' MET . 83.9 mt -70.3 -41.27 73.54 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.828 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 160' ' ' ALA . . . 102.55 -48.61 1.04 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 159' ' ' GLY . . . 175.11 43.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.551 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.766 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 3.8 mmm180 -76.91 153.21 34.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.509 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.766 ' HB3' ' O ' ' A' ' 161' ' ' ARG . . . 91.65 101.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.903 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 26.4 mtmt -64.3 -37.94 89.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.625 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . 0.572 ' O ' ' HB2' ' A' ' 165' ' ' HIS . . . 70.99 -117.57 6.96 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.801 -0.92 . . . . 0.0 110.801 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.572 ' HB2' ' O ' ' A' ' 164' ' ' GLY . 60.7 m170 73.33 76.88 0.14 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.995 0.426 . . . . 0.0 110.853 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -93.04 138.1 31.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.522 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 12.2 m170 -64.64 148.64 50.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.83 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -72.97 160.26 32.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.375 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 -59.06 -45.09 91.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.358 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.385 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.544 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.647 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -70.07 113.08 6.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.442 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.11 -39.89 91.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.291 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.622 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -54.1 -47.79 66.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.351 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.633 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 22.9 m-30 -71.66 -31.86 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 178.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -46.09 82.91 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.538 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -64.4 -35.61 81.45 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 177.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.551 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -57.32 -40.37 77.78 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.831 HG22 HD12 ' A' ' 78' ' ' LEU . 92.3 t -61.07 -47.14 94.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -69.12 -30.65 68.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.095 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 92.4 mm-40 -69.4 -36.56 76.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.924 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.81 HD12 HD11 ' A' ' 78' ' ' LEU . 13.5 mt -51.4 125.37 14.18 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.797 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.937 HG23 ' H ' ' A' ' 16' ' ' GLN . 9.9 t -60.66 167.9 2.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.259 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.538 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.8 tm-20 -60.08 -42.27 94.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.777 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -70.8 -50.7 32.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.163 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.937 ' H ' HG23 ' A' ' 13' ' ' THR . 5.9 tt0 -61.89 -44.76 96.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.143 0.497 . . . . 0.0 110.333 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -66.56 -33.43 75.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.773 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.538 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 65.0 t30 -58.25 -42.58 86.71 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.99 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -62.67 -45.48 92.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.032 0.444 . . . . 0.0 110.051 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.655 ' HD1' HD13 ' A' ' 12' ' ' LEU . 12.8 m-85 -64.81 -38.98 92.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.343 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.7 tptp -59.68 -40.93 89.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.727 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.944 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.79 -41.77 96.25 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.83 -38.76 89.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.004 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.746 ' O ' HG22 ' A' ' 28' ' ' VAL . 23.2 t80 -57.4 -49.13 77.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.649 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.542 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.42 -39.16 92.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.384 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.944 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -57.06 -47.44 83.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.627 -179.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.904 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 25.4 m-85 -61.88 -42.27 98.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.494 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.746 HG22 ' O ' ' A' ' 24' ' ' PHE . 18.9 m -101.2 22.91 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.657 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.582 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -57.75 100.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.408 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.97 -5.58 53.45 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.458 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -60.17 138.24 57.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.835 0.35 . . . . 0.0 110.514 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.87 -41.21 91.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.996 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.66 -22.97 19.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.778 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.684 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 89.0 -9.38 77.02 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.598 ' C ' HG11 ' A' ' 28' ' ' VAL . 89.3 p -82.72 136.2 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.681 ' CG1' HG13 ' A' ' 28' ' ' VAL . 96.4 mt -69.05 104.8 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.597 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.613 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 8.9 p -98.63 156.33 16.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.715 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.1 OUTLIER -39.48 -38.48 0.58 Allowed 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.481 -179.277 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.76 -46.06 76.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.976 0.417 . . . . 0.0 110.171 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.613 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 6.7 mp0 -68.75 -39.42 80.3 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.644 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.945 HD22 HD22 ' A' ' 57' ' ' LEU . 6.4 tt -60.5 -49.05 79.09 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.444 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.578 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.09 -36.27 92.69 Favored Glycine 0 CA--C 1.531 1.033 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -51.23 -62.93 1.32 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.039 0.447 . . . . 0.0 109.99 179.596 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.904 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 4.7 t -58.8 -30.88 43.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.903 178.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.689 ' HE3' ' CG ' ' A' ' 52' ' ' PRO . 81.4 mmm -59.18 -41.99 89.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.281 -0.418 . . . . 0.0 109.874 179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.695 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 77.1 mtp180 -67.61 -31.26 71.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.031 0.443 . . . . 0.0 109.847 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 44' ' ' VAL . 19.8 mtm -61.59 -35.96 79.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.098 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.692 ' CD2' ' HB3' ' A' ' 156' ' ' ALA . 11.0 mt -90.3 2.64 55.28 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.568 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.69 -1.0 56.72 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.695 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 28.1 mm100 -86.0 134.72 33.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.855 0.359 . . . . 0.0 110.855 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.605 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 31.8 p30 -131.41 60.1 50.17 Favored Pre-proline 0 C--N 1.326 -0.429 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.4 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.689 ' CG ' ' HE3' ' A' ' 45' ' ' MET . 3.6 Cg_exo -75.9 157.83 38.85 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 C-N-CA 123.519 2.812 . . . . 0.0 112.124 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.4 p -89.28 154.2 48.95 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.03 0.443 . . . . 0.0 110.389 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.61 -42.02 71.92 Favored 'Trans proline' 0 C--N 1.302 -1.916 0 C-N-CA 122.716 2.277 . . . . 0.0 112.031 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.16 -44.76 95.89 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.887 0.375 . . . . 0.0 110.262 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.592 ' O ' ' SD ' ' A' ' 60' ' ' MET . 54.2 tp10 -71.64 -38.53 70.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.167 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.945 HD22 HD22 ' A' ' 41' ' ' LEU . 41.9 mt -60.62 -24.11 65.25 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.759 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.435 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 34.9 tt0 -64.3 -39.9 94.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.827 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -61.1 -44.14 97.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.108 0.48 . . . . 0.0 110.758 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -67.53 -39.67 85.05 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.346 179.585 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.715 HD11 ' N ' ' A' ' 38' ' ' THR . 1.4 mt -61.52 -46.06 97.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.566 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.439 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 38.2 t70 -59.19 -37.45 77.46 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.589 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.4 tt0 -47.44 -35.03 7.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.543 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.605 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 2.5 m -118.51 6.11 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.682 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.455 ' OD2' ' N ' ' A' ' 70' ' ' GLY . 59.0 t0 -117.08 83.24 1.94 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.06 -17.42 63.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.604 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 -13.0 60.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.522 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.22 13.68 60.47 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.3 p -76.58 -12.54 60.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.698 0.285 . . . . 0.0 110.995 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.605 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 75.02 16.29 80.65 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.577 ' HA ' ' O ' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -134.48 115.24 13.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.978 0.418 . . . . 0.0 111.101 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.821 HG23 ' N ' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -90.58 105.55 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.199 179.311 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.539 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -72.69 -162.97 0.11 Allowed 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.65 179.678 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.887 ' HE1' HD23 ' A' ' 78' ' ' LEU . 0.7 OUTLIER -58.1 -51.41 69.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.811 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.474 ' O ' HG23 ' A' ' 79' ' ' VAL . 1.2 p30 -65.33 -42.27 93.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.711 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.578 ' O ' ' HB ' ' A' ' 64' ' ' VAL . 53.0 mt-10 -62.36 -42.24 99.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.451 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.821 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -73.89 -42.86 60.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.127 0.489 . . . . 0.0 110.142 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.887 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.11 -34.77 45.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.732 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.609 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 46.4 t -60.58 -44.06 95.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.002 178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.635 ' HE3' ' CA ' ' A' ' 77' ' ' PHE . 5.2 ptp -56.97 -40.1 75.87 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.053 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.6 ' O ' ' HG3' ' A' ' 85' ' ' MET . 35.2 mmt -61.55 -45.43 94.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.146 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.813 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 0.2 OUTLIER -76.13 -25.0 16.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.213 179.158 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.633 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 62.3 mtt-85 -60.54 -41.41 94.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.718 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.477 ' O ' ' HA3' ' A' ' 136' ' ' GLY . 96.4 p -86.27 -30.61 22.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.034 0.445 . . . . 0.0 110.544 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.813 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 65.0 mtm -59.35 -33.81 71.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.73 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.475 ' C ' ' H ' ' A' ' 88' ' ' ASP . 12.8 tttm -41.79 -44.69 3.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.452 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.503 ' OD2' ' O ' ' A' ' 85' ' ' MET . 46.5 m-20 59.77 1.37 0.3 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.586 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.475 ' H ' ' C ' ' A' ' 86' ' ' LYS . 67.5 m-20 -87.69 -38.38 15.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.845 0.355 . . . . 0.0 110.493 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 70.6 m -120.36 -25.32 5.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.564 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.431 ' HE3' ' HE ' ' A' ' 147' ' ' ARG . 22.1 ptmt -156.08 160.45 39.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.678 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.477 ' HA3' ' O ' ' A' ' 84' ' ' SER . . . 94.39 -16.36 61.24 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.044 -0.823 . . . . 0.0 111.044 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -66.85 -40.53 87.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.836 0.35 . . . . 0.0 110.767 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -54.93 135.37 48.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.574 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 140' ' ' ARG . 7.6 ptmt -159.86 142.34 13.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.851 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.606 ' CD ' ' HD2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER 167.22 155.96 0.12 Allowed Pre-proline 0 N--CA 1.463 0.195 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.708 179.474 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.606 ' HD2' ' CD ' ' A' ' 140' ' ' ARG . 57.2 Cg_endo -86.0 -8.71 7.78 Favored 'Trans proline' 0 C--N 1.298 -2.101 0 C-N-CA 123.45 2.767 . . . . 0.0 112.206 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.651 HG22 ' N ' ' A' ' 143' ' ' LEU . 1.5 m -45.61 -75.13 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.446 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.651 ' N ' HG22 ' A' ' 142' ' ' THR . 97.3 mt -150.12 151.74 33.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.505 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.455 ' HD2' ' OG ' ' A' ' 149' ' ' SER . 0.0 OUTLIER -133.3 77.33 1.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.829 179.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -115.51 18.96 15.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.765 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.6 ' O ' ' C ' ' A' ' 147' ' ' ARG . 2.1 m -118.33 -165.24 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.739 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.6 ' C ' ' O ' ' A' ' 146' ' ' VAL . 7.3 ptp85 -19.97 128.52 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.347 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.766 HD11 ' HG3' ' A' ' 153' ' ' MET . 20.7 tt -38.85 139.9 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.644 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.646 ' O ' ' CB ' ' A' ' 153' ' ' MET . 43.0 m -76.17 84.07 3.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -44.28 -37.64 3.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.61 -88.24 0.0 OUTLIER 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.261 0.553 . . . . 0.0 110.907 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.13 -25.95 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.759 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.766 ' HG3' HD11 ' A' ' 148' ' ' ILE . 0.0 OUTLIER -52.36 -49.87 63.49 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.454 179.754 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.824 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.9 mtp -69.74 -31.47 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.479 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -60.23 -41.87 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.313 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . 0.692 ' HB3' ' CD2' ' A' ' 48' ' ' LEU . . . -65.76 -43.66 88.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.033 0.444 . . . . 0.0 110.966 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.662 ' HB3' HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -63.24 -44.63 94.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.577 -179.433 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 22' ' ' ALA . 83.2 mt -82.65 -6.83 59.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.221 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.589 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 68.31 28.64 73.19 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.921 -0.871 . . . . 0.0 110.921 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 74.19 39.94 0.46 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.779 0.323 . . . . 0.0 110.396 -179.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 15.5 ttt85 -81.37 134.59 35.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.699 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -124.27 131.54 53.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.391 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . 0.419 ' O ' ' HE1' ' A' ' 168' ' ' HIS . 22.1 tttt -139.85 128.75 23.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.522 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 101.92 79.15 1.37 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.986 -0.845 . . . . 0.0 110.986 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.49 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 97.9 m-70 56.23 41.0 29.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.74 0.305 . . . . 0.0 110.755 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 0.1 OUTLIER 76.7 -154.03 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.622 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -69.01 171.3 8.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.694 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.419 ' HE1' ' O ' ' A' ' 163' ' ' LYS . 69.3 m80 -120.11 49.14 1.45 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.214 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . 0.568 ' O ' ' C ' ' A' ' 170' ' ' HIS . 86.3 t60 -59.31 -45.66 90.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.387 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . 0.568 ' C ' ' O ' ' A' ' 169' ' ' HIS . 0.2 OUTLIER . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.579 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.605 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.475 ' SD ' ' HB2' ' A' ' 66' ' ' GLU . 3.6 mtp . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.65 106.57 0.36 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.478 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 98.3 m-20 -61.23 -38.52 86.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.966 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.634 HG23 ' CD2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -55.63 -45.83 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 121.37 0.605 . . . . 0.0 109.476 179.655 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.642 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 21.0 m-30 -71.88 -30.25 65.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.577 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.2 mmpt? -57.56 -46.11 84.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.553 0.692 . . . . 0.0 109.194 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.484 ' O ' ' HG3' ' A' ' 11' ' ' GLN . . . -63.87 -35.28 80.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.157 177.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -57.37 -40.95 79.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.663 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.744 HG22 HD12 ' A' ' 78' ' ' LEU . 75.7 t -62.9 -46.28 96.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -73.6 -20.42 60.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.038 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 7' ' ' ALA . 2.8 mt-30 -71.06 -36.25 72.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.86 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.721 HD13 ' CD1' ' A' ' 20' ' ' PHE . 31.3 mt -56.41 128.01 33.86 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.949 HG23 ' H ' ' A' ' 16' ' ' GLN . 7.5 t -60.67 167.7 2.58 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.959 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -55.42 -39.75 70.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.835 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -74.18 -46.84 39.57 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.745 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.949 ' H ' HG23 ' A' ' 13' ' ' THR . 65.5 tt0 -62.68 -43.97 97.45 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.964 0.411 . . . . 0.0 110.588 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 30.8 ttmt -65.61 -35.55 81.14 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -60.51 -43.71 96.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.853 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.496 ' HG2' HD11 ' A' ' 158' ' ' LEU . 8.7 tt0 -62.66 -46.5 87.91 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.721 ' CD1' HD13 ' A' ' 12' ' ' LEU . 23.5 m-85 -65.07 -39.45 93.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.876 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -59.36 -39.94 84.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.747 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 1.015 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.03 -41.27 91.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.71 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.859 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -60.69 -39.73 89.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.999 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.661 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 29.8 t80 -57.8 -48.91 78.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.846 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 29' ' ' LEU . 47.8 t0 -63.01 -39.23 94.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.451 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 1.015 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.8 OUTLIER -57.37 -44.28 83.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.748 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.935 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 14.4 m-85 -61.85 -42.13 98.67 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.056 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.788 HG11 ' O ' ' A' ' 34' ' ' GLY . 6.6 m -101.29 25.14 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.746 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB3' ' HZ1' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -56.28 107.59 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.262 -179.642 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 86.63 6.15 80.73 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.454 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -64.52 139.42 58.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.547 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -64.24 -41.88 96.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.991 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.51 -22.35 17.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.643 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.788 ' O ' HG11 ' A' ' 28' ' ' VAL . . . 88.02 -8.52 77.9 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.65 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 92.1 p -83.44 136.99 34.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.342 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.639 ' HB ' HG13 ' A' ' 72' ' ' VAL . 97.5 mt -73.45 106.71 3.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.172 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.599 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 32.5 p -102.17 -175.1 2.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.152 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.915 HG23 HD12 ' A' ' 61' ' ' ILE . 6.4 p -64.19 -30.32 71.39 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.442 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.6 mmtt -72.58 -50.53 24.84 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.192 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.599 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 20.4 mp0 -69.68 -40.71 76.22 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.296 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.955 HD22 HD22 ' A' ' 57' ' ' LEU . 8.2 tt -62.32 -51.4 67.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.434 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.479 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.85 -30.34 77.72 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.489 ' HZ1' ' HB3' ' A' ' 29' ' ' LEU . 0.0 OUTLIER -54.56 -49.86 69.32 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.768 0.318 . . . . 0.0 110.262 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 1.056 HG22 ' SD ' ' A' ' 47' ' ' MET . 1.3 t -72.94 -30.41 32.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.808 ' SD ' HD12 ' A' ' 148' ' ' ILE . 88.1 mmm -59.31 -45.08 92.27 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.609 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 73.4 mtp85 -67.25 -37.49 83.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 178.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 1.056 ' SD ' HG22 ' A' ' 44' ' ' VAL . 1.5 ptm -52.9 -30.23 33.02 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.499 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.617 HD13 ' HA ' ' A' ' 153' ' ' MET . 16.6 mt -93.31 -5.46 49.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.776 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 105.57 7.42 36.89 Favored Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.609 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 58.9 mm-40 -85.44 138.86 31.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.777 0.322 . . . . 0.0 111.038 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.465 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 30.1 t-20 -126.36 59.14 29.86 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.376 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.589 ' HG2' HD11 ' A' ' 57' ' ' LEU . 73.4 Cg_endo -80.19 142.04 14.94 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 C-N-CA 122.718 2.279 . . . . 0.0 112.864 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.566 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 63.6 p -81.16 160.5 65.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.376 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -56.86 -36.82 99.07 Favored 'Trans proline' 0 C--N 1.295 -2.271 0 C-N-CA 122.747 2.298 . . . . 0.0 111.761 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -62.18 -49.47 75.66 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.978 0.418 . . . . 0.0 110.763 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.574 ' OE2' ' HB2' ' A' ' 52' ' ' PRO . 1.3 pp20? -72.56 -34.99 67.88 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.955 HD22 HD22 ' A' ' 41' ' ' LEU . 38.2 mt -65.16 -41.7 94.43 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.584 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.466 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 29.0 tt0 -61.93 -42.22 98.84 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.18 -179.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -62.55 -51.8 65.95 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.426 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.792 ' CE ' HD21 ' A' ' 41' ' ' LEU . 2.5 ppp? -58.49 -34.65 71.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.035 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.915 HD12 HG23 ' A' ' 38' ' ' THR . 15.5 mt -60.92 -44.57 98.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.082 0.468 . . . . 0.0 110.807 177.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.634 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 34.1 t70 -61.0 -27.43 68.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.854 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HB3' 'CL1 ' ' A' ' 201' ' ' V8Y . 2.1 tp10 -49.4 -38.44 28.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.62 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 0.3 OUTLIER -111.95 -3.78 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.732 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.634 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 51.4 t0 -79.65 104.78 10.48 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.195 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.475 ' HB2' ' SD ' ' A' ' 1' ' ' MET . 64.4 tt0 -63.62 -45.59 89.61 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.418 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.573 ' OD1' ' OD1' ' A' ' 65' ' ' ASP . 54.6 p30 -91.38 -0.19 57.61 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.839 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.539 ' N ' ' OD1' ' A' ' 65' ' ' ASP . . . 60.42 29.75 69.92 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.608 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 3.0 p -69.79 -0.02 6.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.839 0.352 . . . . 0.0 110.763 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.564 ' N ' ' OD2' ' A' ' 65' ' ' ASP . . . 76.77 14.23 82.76 Favored Glycine 0 CA--C 1.521 0.409 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.65 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 2.0 p -139.74 132.51 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -101.64 110.0 27.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.002 179.173 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.451 ' CG ' ' OE1' ' A' ' 76' ' ' GLU . 55.2 p-10 -78.98 -169.05 1.65 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.227 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.881 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.1 t80 -55.64 -50.09 71.13 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.452 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.543 ' O ' HG23 ' A' ' 79' ' ' VAL . 98.2 m-20 -62.43 -42.77 99.7 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.118 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' A' ' 65' ' ' ASP . 25.7 mt-10 -64.81 -42.07 95.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.381 0.61 . . . . 0.0 110.354 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.683 ' CZ ' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -69.62 -44.9 69.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.916 179.532 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.881 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -57.05 -37.21 71.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.757 ' O ' HG13 ' A' ' 82' ' ' VAL . 42.1 t -60.97 -43.25 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.207 178.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.428 ' HB2' HG11 ' A' ' 64' ' ' VAL . 1.6 ttm -54.48 -42.76 71.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.536 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.539 ' O ' ' HG3' ' A' ' 85' ' ' MET . 14.4 mmt -59.85 -45.45 92.39 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.49 . . . . 0.0 110.282 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.757 HG13 ' O ' ' A' ' 79' ' ' VAL . 0.6 OUTLIER -72.23 -31.87 40.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.434 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.642 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 59.8 mtt-85 -60.95 -43.67 98.37 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.321 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.585 ' O ' ' N ' ' A' ' 88' ' ' ASP . 95.0 p -70.63 -35.4 72.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.261 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.749 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 52.6 mtm -61.89 -40.92 97.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.727 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.7 tptp -68.86 -42.11 77.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 110.649 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -99.68 13.4 33.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.631 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.585 ' N ' ' O ' ' A' ' 84' ' ' SER . 16.3 t0 -56.48 -49.52 74.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.029 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.5 t -141.19 132.39 26.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.783 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -61.37 -45.11 95.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.501 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -124.11 -103.02 1.53 Allowed Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -120.16 -62.15 1.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.845 0.355 . . . . 0.0 110.666 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.586 ' O ' ' N ' ' A' ' 140' ' ' ARG . 15.3 m-85 -149.76 -93.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.659 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.496 ' C ' ' O ' ' A' ' 138' ' ' PHE . 1.5 mtpt 31.3 -89.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.817 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.586 ' N ' ' O ' ' A' ' 138' ' ' PHE . 19.5 mmt180 -118.89 165.25 17.4 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.205 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.567 ' HD2' ' HB3' ' A' ' 140' ' ' ARG . 56.3 Cg_endo -83.01 164.83 15.31 Favored 'Trans proline' 0 C--N 1.298 -2.08 0 C-N-CA 123.62 2.88 . . . . 0.0 112.375 -178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.594 HG22 ' N ' ' A' ' 143' ' ' LEU . 88.7 m -63.75 -97.89 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.966 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.594 ' N ' HG22 ' A' ' 142' ' ' THR . 0.5 OUTLIER -126.12 -81.52 0.62 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.713 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 144' ' ' ARG . 31.5 mtp-105 -109.71 129.38 55.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.254 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.806 ' C ' HG23 ' A' ' 146' ' ' VAL . 54.6 mtm180 -114.62 -157.67 0.64 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.347 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.806 HG23 ' C ' ' A' ' 145' ' ' ARG . 1.3 t 77.64 44.7 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.439 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.607 ' O ' ' C ' ' A' ' 148' ' ' ILE . 0.2 OUTLIER -96.47 86.78 4.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.542 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.862 ' O ' HG23 ' A' ' 148' ' ' ILE . 11.1 tt 16.38 73.39 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.8 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.564 ' C ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -26.88 111.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.635 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.508 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -60.67 -39.49 88.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.483 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.554 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -44.69 -80.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.132 0.492 . . . . 0.0 110.457 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.81 -35.81 77.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.773 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.705 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 13.6 ttt -49.94 -51.84 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.885 0.374 . . . . 0.0 110.291 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.859 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 16.1 mtp -69.43 -32.04 70.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.472 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.554 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.6 mt-30 -59.9 -42.06 93.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.103 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . 0.495 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.52 -42.88 98.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.388 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.758 HD22 HG21 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -66.65 -38.04 86.05 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.55 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.496 HD11 ' HG2' ' A' ' 19' ' ' GLU . 86.9 mt -82.91 -7.52 59.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.383 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 66.46 29.97 75.73 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 66.35 35.46 5.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.77 0.319 . . . . 0.0 110.613 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 161' ' ' ARG . 0.0 OUTLIER -65.33 98.89 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.297 179.737 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -136.34 177.11 8.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.655 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . 0.502 ' O ' ' HB3' ' A' ' 167' ' ' HIS . 2.1 mptm? -115.8 107.48 15.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.627 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -91.16 -170.34 42.63 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 57.42 103.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.798 0.332 . . . . 0.0 110.329 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 63.4 m170 61.32 34.04 18.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.649 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . 0.502 ' HB3' ' O ' ' A' ' 163' ' ' LYS . 26.6 p80 -76.76 168.96 19.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.725 179.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 32.5 p80 -155.69 161.43 40.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.488 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -160.42 167.78 26.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.654 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 10.4 p80 . . . . . 0 C--O 1.221 -0.402 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.665 179.959 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.403 'CL1 ' ' HB3' ' A' ' 63' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.539 ' HB2' ' OE1' ' A' ' 66' ' ' GLU . 27.3 ttt . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.576 ' OD2' ' CE1' ' A' ' 5' ' ' TYR . 0.5 OUTLIER -43.36 99.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.475 -179.859 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.403 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 79.2 m-20 -61.57 -40.72 95.77 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.623 ' C ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -56.0 -46.71 80.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.362 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.65 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 22.1 m-30 -68.65 -33.68 74.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.562 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.4 OUTLIER -56.89 -46.86 81.63 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' O ' ' HG2' ' A' ' 11' ' ' GLN . . . -62.55 -35.71 80.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -55.66 -40.95 72.96 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.251 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.786 HG22 HD12 ' A' ' 78' ' ' LEU . 68.8 t -63.14 -46.95 94.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.91 -23.3 61.45 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.543 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 7' ' ' ALA . 84.2 mm-40 -70.43 -35.72 73.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.658 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.7 ' CD1' HD11 ' A' ' 78' ' ' LEU . 21.9 mt -57.76 126.09 25.85 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.641 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.876 HG23 ' H ' ' A' ' 16' ' ' GLN . 1.5 t -64.12 175.19 1.31 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.284 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 15.0 mm-40 -60.88 -43.06 98.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.59 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -71.55 -48.14 50.5 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.876 ' H ' HG23 ' A' ' 13' ' ' THR . 8.1 tt0 -61.18 -43.86 98.21 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.295 0.569 . . . . 0.0 110.393 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 31.1 ttmt -68.26 -32.23 72.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.63 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 18.2 t-20 -60.87 -44.24 97.33 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.884 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -60.71 -44.37 96.68 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.129 0.49 . . . . 0.0 109.835 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.653 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 30.6 m-85 -66.76 -38.04 85.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.847 179.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -60.25 -40.11 89.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.074 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.915 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -59.79 -42.02 92.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.741 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.66 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -62.21 -40.29 95.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.582 ' HB2' ' CD2' ' A' ' 77' ' ' PHE . 16.8 t80 -57.64 -49.17 77.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.787 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 29' ' ' LEU . 36.1 t70 -63.49 -40.16 96.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.606 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.97 HD13 ' CB ' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -57.81 -44.02 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.584 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.779 ' CE1' HG11 ' A' ' 44' ' ' VAL . 17.4 m-85 -61.71 -43.12 99.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.738 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.666 HG21 ' O ' ' A' ' 34' ' ' GLY . 28.0 m -102.9 26.96 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.621 ' HB3' ' HZ1' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -57.49 105.67 0.26 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.376 -179.722 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 3.4 67.82 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.485 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -63.44 136.44 57.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.289 . . . . 0.0 110.368 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -61.81 -44.79 96.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.544 ' O ' ' OD1' ' A' ' 33' ' ' ASP . 64.6 t0 -92.43 -22.37 19.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.666 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 88.51 -8.04 80.11 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.547 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 59.5 p -81.15 137.52 35.93 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.631 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.657 ' CG1' HG13 ' A' ' 28' ' ' VAL . 96.6 mt -74.19 105.8 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.056 0.455 . . . . 0.0 110.974 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.682 ' CB ' HG22 ' A' ' 71' ' ' THR . 4.8 p -102.45 -172.49 2.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.693 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.608 ' O ' HD13 ' A' ' 57' ' ' LEU . 16.3 p -60.88 -37.18 81.27 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.437 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -69.93 -49.18 54.53 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.337 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.583 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 46.9 mp0 -64.35 -42.9 96.0 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.846 HD23 HD22 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -64.06 -48.54 75.83 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.89 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -62.2 -37.55 94.71 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 110.581 -1.008 . . . . 0.0 110.581 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.621 ' HZ1' ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -50.37 -63.45 1.12 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 109.851 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.904 HG22 ' HE2' ' A' ' 47' ' ' MET . 13.2 t -59.45 -36.29 63.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.662 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 77.8 mmm -55.35 -39.5 70.12 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.667 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 10.4 mtm105 -66.68 -32.85 74.42 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.904 ' HE2' HG22 ' A' ' 44' ' ' VAL . 32.6 mtm -59.18 -37.43 77.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.947 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.783 ' N ' HD22 ' A' ' 48' ' ' LEU . 2.3 mm? -83.76 -5.33 59.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.623 179.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.37 11.22 34.14 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.667 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 10.7 mm100 -91.25 138.74 31.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.154 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.452 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 34.6 p30 -127.24 57.75 25.75 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.892 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.514 ' HB2' ' HG ' ' A' ' 57' ' ' LEU . 68.9 Cg_endo -78.47 150.4 25.02 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.711 2.274 . . . . 0.0 112.56 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.7 p -89.96 156.51 46.78 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.597 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.504 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 52.3 Cg_exo -55.6 -40.26 86.35 Favored 'Trans proline' 0 C--N 1.301 -1.935 0 C-N-CA 122.762 2.308 . . . . 0.0 111.909 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -61.3 -49.65 76.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.497 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.458 ' O ' ' SD ' ' A' ' 60' ' ' MET . 78.7 mm-40 -69.37 -38.99 78.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.18 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.846 HD22 HD23 ' A' ' 41' ' ' LEU . 26.3 mt -60.25 -28.43 68.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.698 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -58.87 -40.02 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.126 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -63.49 -47.85 80.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.631 0.729 . . . . 0.0 110.779 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.547 ' HG2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.17 -38.9 90.85 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.914 179.698 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.777 HG21 ' O ' ' A' ' 70' ' ' GLY . 17.3 mm -62.36 -45.56 98.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.362 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.638 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 15.0 t70 -64.26 -23.14 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.807 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.531 ' O ' ' NH1' ' A' ' 83' ' ' ARG . 42.6 tp10 -53.66 -41.08 66.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.572 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.596 HG13 'CL1 ' ' A' ' 201' ' ' V8Y . 0.9 OUTLIER -114.68 -3.52 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.4 . . . . 0.0 110.718 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.638 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 63.5 t0 -88.16 88.67 7.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.539 ' OE1' ' HB2' ' A' ' 1' ' ' MET . 77.9 tt0 -71.88 -26.74 62.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.924 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.56 -11.46 60.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.967 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.04 21.73 64.06 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.019 -0.833 . . . . 0.0 111.019 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 p -85.93 0.7 52.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.887 0.375 . . . . 0.0 110.747 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.777 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 72.69 15.51 77.84 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.682 HG22 ' CB ' ' A' ' 37' ' ' SER . 9.8 p -139.43 126.9 21.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.903 0.382 . . . . 0.0 110.657 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.691 HG22 ' O ' ' A' ' 72' ' ' VAL . 0.2 OUTLIER -91.37 107.72 19.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.348 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.463 ' OD1' ' CG ' ' A' ' 76' ' ' GLU . 52.3 p-10 -74.34 -169.08 0.75 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.508 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 1.027 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.8 t80 -57.41 -50.69 72.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.146 -179.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -62.93 -41.92 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.816 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.614 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 30.8 mt-10 -64.87 -43.26 93.52 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.189 0.519 . . . . 0.0 110.381 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.707 ' HA ' ' HE3' ' A' ' 80' ' ' MET . 0.0 OUTLIER -68.88 -39.76 79.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.443 0.639 . . . . 0.0 109.724 179.739 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.027 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -60.38 -37.03 79.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.431 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.621 ' O ' HG13 ' A' ' 82' ' ' VAL . 28.3 t -61.88 -42.28 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.967 178.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.707 ' HE3' ' HA ' ' A' ' 77' ' ' PHE . 2.6 ptp -56.48 -38.54 71.87 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.878 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.577 ' O ' ' HG3' ' A' ' 85' ' ' MET . 21.1 mmt -62.42 -47.76 82.67 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.756 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.978 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 0.1 OUTLIER -72.39 -33.01 44.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.292 179.179 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.629 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 72.5 mtt180 -60.57 -43.82 96.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.248 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 72.4 m -69.94 -38.24 76.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.331 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.978 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 67.2 mtm -61.38 -40.78 95.59 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.655 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.554 ' O ' ' OD2' ' A' ' 87' ' ' ASP . 5.0 mmtt -78.82 -29.37 44.71 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.48 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.554 ' OD2' ' O ' ' A' ' 86' ' ' LYS . 0.0 OUTLIER 60.31 -170.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.492 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.438 ' O ' ' C ' ' A' ' 89' ' ' SER . 54.9 p-10 -82.41 -3.42 55.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.613 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 88' ' ' ASP . 82.7 p -37.12 130.64 0.84 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.471 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -154.77 92.85 1.5 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.51 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.44 -133.02 11.41 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.51 -89.36 0.28 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 0.0 110.664 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -112.0 123.29 49.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.712 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 2.7 mtpt -106.21 -177.5 3.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.6 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.571 ' HB2' ' CD ' ' A' ' 141' ' ' PRO . 8.9 ptp180 -110.95 179.88 0.74 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.301 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.571 ' CD ' ' HB2' ' A' ' 140' ' ' ARG . 29.2 Cg_exo -60.51 102.55 0.19 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.856 2.371 . . . . 0.0 111.864 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.706 HG22 ' HG ' ' A' ' 143' ' ' LEU . 85.4 m -169.96 126.45 0.84 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.76 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.706 ' HG ' HG22 ' A' ' 142' ' ' THR . 68.3 mt 67.02 66.59 0.42 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.832 0.348 . . . . 0.0 110.829 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.498 ' O ' ' NH1' ' A' ' 147' ' ' ARG . 77.7 mtt-85 -66.25 148.54 51.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.78 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.537 ' C ' HG23 ' A' ' 146' ' ' VAL . 11.7 mtm-85 -68.31 -94.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.68 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.537 HG23 ' C ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER 43.59 32.48 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.469 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.498 ' NH1' ' O ' ' A' ' 144' ' ' ARG . 0.8 OUTLIER -87.4 169.75 11.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.463 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.464 ' O ' HG23 ' A' ' 148' ' ' ILE . 5.4 tp -34.98 124.95 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.465 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.61 ' O ' ' CB ' ' A' ' 153' ' ' MET . 29.6 m -71.87 88.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.986 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.585 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.62 -31.95 69.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.834 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -53.02 -48.69 67.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.038 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.405 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -107.56 -18.98 13.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.954 0.407 . . . . 0.0 111.064 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.726 ' HE2' ' CZ ' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -57.12 -45.98 83.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.226 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.66 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 mtp -70.01 -29.82 66.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.577 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.405 ' OE1' ' HA ' ' A' ' 152' ' ' ALA . 82.3 mt-30 -62.05 -39.61 92.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.449 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' A' ' 48' ' ' LEU . . . -62.27 -25.27 67.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.781 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.97 ' CB ' HD13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -97.13 -51.97 4.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.756 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 94.6 mt -69.51 -38.14 77.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.543 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 90.3 42.73 5.15 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 69.04 40.07 1.65 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.786 0.327 . . . . 0.0 110.632 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.487 ' HB2' ' HB3' ' A' ' 158' ' ' LEU . 69.0 mtp85 -105.34 -11.1 16.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.543 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -133.19 45.0 2.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.48 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -46.74 128.51 10.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.322 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -96.67 106.18 3.32 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.899 -0.881 . . . . 0.0 110.899 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 37.7 m170 -64.52 -40.16 95.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.59 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.0 t-160 -71.82 125.69 27.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.572 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -147.69 71.75 1.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.282 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.466 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 53.5 t-80 60.19 38.88 19.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.661 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -116.53 127.76 54.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.698 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.498 179.923 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.596 'CL1 ' HG13 ' A' ' 64' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.548 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 96.1 mtp . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -60.95 126.6 27.96 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.48 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.444 ' O ' ' HB3' ' A' ' 6' ' ' LYS . 71.4 m-20 -68.82 -39.5 80.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.573 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.889 HD11 ' HE3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -54.7 -47.89 72.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.649 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.663 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 20.9 m-30 -69.2 -31.89 70.8 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.551 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -58.76 -45.37 89.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.05 -34.15 76.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.511 ' HB3' ' O ' ' A' ' 5' ' ' TYR . . . -58.39 -42.01 86.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.758 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.838 HG22 HD12 ' A' ' 78' ' ' LEU . 95.4 t -63.71 -43.95 98.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -68.58 -24.3 64.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.522 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -71.15 -35.4 71.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.691 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.832 HD13 ' CD1' ' A' ' 20' ' ' PHE . 17.2 mt -64.5 107.8 1.48 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.277 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.706 HG23 ' H ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -51.21 -179.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.649 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.553 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 76.5 mm-40 -60.92 -44.77 96.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.981 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -70.92 -45.7 63.8 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.95 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.706 ' H ' HG23 ' A' ' 13' ' ' THR . 29.5 tt0 -63.66 -44.34 94.08 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.178 0.514 . . . . 0.0 110.127 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.586 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.6 ttmt -70.44 -30.83 67.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.589 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.553 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 63.0 t30 -60.33 -44.46 95.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.106 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.41 -45.44 93.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.106 0.479 . . . . 0.0 109.947 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.832 ' CD1' HD13 ' A' ' 12' ' ' LEU . 28.4 m-85 -65.11 -39.01 92.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.198 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -60.53 -39.51 88.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.836 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.895 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.53 -42.22 96.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.852 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.753 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.66 -39.41 91.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.181 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.707 ' O ' HG22 ' A' ' 28' ' ' VAL . 17.2 t80 -57.27 -48.63 78.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.638 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.587 ' O ' ' N ' ' A' ' 29' ' ' LEU . 65.0 t0 -62.75 -39.55 94.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.527 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.895 HD12 ' O ' ' A' ' 22' ' ' ALA . 0.6 OUTLIER -56.65 -45.88 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.528 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.709 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 22.6 m-85 -62.03 -41.99 98.69 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.365 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.707 HG22 ' O ' ' A' ' 24' ' ' PHE . 15.7 m -101.57 21.36 2.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.427 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.3 OUTLIER -53.12 112.47 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.325 -179.825 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 91.32 -9.07 78.35 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.926 -0.87 . . . . 0.0 110.926 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.595 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -63.15 127.03 29.38 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.247 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.11 -41.39 97.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.56 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 55.5 p30 -81.36 -22.38 38.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.874 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.56 ' N ' ' OD1' ' A' ' 33' ' ' ASP . . . 78.73 -2.5 68.01 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.58 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 57.6 p -90.6 136.93 32.75 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.878 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -73.6 106.22 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.662 -0.415 . . . . 0.0 111.358 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.585 ' OG ' ' OE1' ' A' ' 40' ' ' GLU . 56.1 p -101.94 161.65 13.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.798 179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.86 ' N ' HD11 ' A' ' 61' ' ' ILE . 0.8 OUTLIER -41.66 -35.58 0.79 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.611 -179.339 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -49.54 57.31 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.585 ' OE1' ' OG ' ' A' ' 37' ' ' SER . 3.4 mp0 -67.18 -40.06 86.51 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.877 ' CD2' HD22 ' A' ' 57' ' ' LEU . 6.6 tt -60.06 -50.44 73.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.44 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.458 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -64.93 -35.74 92.26 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.5 -60.98 2.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.22 0.534 . . . . 0.0 109.947 -179.757 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.85 HG22 ' HE2' ' A' ' 47' ' ' MET . 25.5 t -61.06 -38.93 80.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.894 -0.409 . . . . 0.0 109.894 177.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.636 ' HB3' ' HB2' ' A' ' 50' ' ' GLN . 88.8 mmm -54.46 -41.6 69.67 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 71.6 mtp180 -65.01 -32.65 74.49 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.85 ' HE2' HG22 ' A' ' 44' ' ' VAL . 33.1 mtm -58.7 -37.3 75.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.965 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.828 ' N ' HD22 ' A' ' 48' ' ' LEU . 2.1 mm? -85.76 0.01 54.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.516 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.36 5.45 57.01 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.645 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 5.8 mm-40 -80.53 138.49 36.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.961 0.41 . . . . 0.0 110.955 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.463 ' N ' ' HD3' ' A' ' 52' ' ' PRO . 26.6 p-10 -128.54 56.79 24.28 Favored Pre-proline 0 C--N 1.326 -0.451 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.309 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.7 ' CG ' HD21 ' A' ' 57' ' ' LEU . 64.0 Cg_endo -77.67 139.86 18.27 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.721 2.281 . . . . 0.0 112.864 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.6 p -78.6 158.16 76.29 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.181 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.47 -35.21 84.57 Favored 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.726 2.284 . . . . 0.0 111.824 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -61.02 -51.6 68.53 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.21 0.529 . . . . 0.0 110.387 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.579 ' O ' ' CE ' ' A' ' 60' ' ' MET . 72.9 mt-10 -69.64 -39.89 76.84 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.327 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.877 HD22 ' CD2' ' A' ' 41' ' ' LEU . 43.4 mt -61.48 -37.75 84.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.678 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.527 ' HA ' ' CG2' ' A' ' 38' ' ' THR . 50.6 tt0 -59.8 -41.36 91.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.733 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 -62.85 -41.86 99.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.255 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.579 ' CE ' ' O ' ' A' ' 56' ' ' GLU . 4.4 mmt -62.57 -39.09 92.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.86 HD11 ' N ' ' A' ' 38' ' ' THR . 2.8 mt -61.65 -45.7 98.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.489 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 14.9 t70 -60.14 -36.08 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.565 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -45.98 -38.91 8.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.157 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.563 ' CG1' ' HD3' ' A' ' 83' ' ' ARG . 0.6 OUTLIER -113.88 -10.11 12.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.489 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 16.0 t70 -96.65 67.37 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.323 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.548 ' OE1' ' HA ' ' A' ' 1' ' ' MET . 51.0 mt-10 -67.71 -17.62 64.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.793 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.466 ' OD1' ' OD2' ' A' ' 65' ' ' ASP . 49.6 p-10 -75.93 -10.3 59.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.496 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.68 14.45 75.26 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.074 -0.81 . . . . 0.0 111.074 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.451 ' N ' ' OD2' ' A' ' 65' ' ' ASP . 88.1 p -71.86 -16.84 62.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.617 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.46 ' C ' HG21 ' A' ' 61' ' ' ILE . . . 72.97 17.04 78.34 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.583 ' CG2' ' HB3' ' A' ' 37' ' ' SER . 0.2 OUTLIER -149.2 119.43 7.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.924 0.392 . . . . 0.0 110.76 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.878 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.1 OUTLIER -85.99 110.38 19.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.44 179.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.543 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -81.49 -162.29 0.5 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.886 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.9 t80 -56.72 -49.52 74.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.775 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.468 ' O ' HG23 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -65.6 -44.96 85.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.644 179.526 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.62 ' C ' HG23 ' A' ' 72' ' ' VAL . 53.2 mt-10 -62.69 -41.37 99.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.321 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.759 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -71.04 -44.34 66.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.186 0.517 . . . . 0.0 109.634 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.886 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -56.1 -37.33 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.619 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.605 HG12 ' CD ' ' A' ' 83' ' ' ARG . 42.6 t -63.84 -41.73 93.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.037 178.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.735 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -54.25 -38.34 65.68 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.204 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.735 ' N ' ' HG2' ' A' ' 80' ' ' MET . 12.7 mmt -65.36 -48.25 73.61 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 121.255 0.55 . . . . 0.0 110.848 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.97 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 0.1 OUTLIER -72.78 -28.75 27.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.613 179.543 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.663 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 65.0 mtp85 -59.18 -48.06 83.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.634 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 84.8 p -70.48 -37.0 74.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.668 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.97 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 67.9 mtm -60.83 -48.03 83.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.385 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.889 ' HE3' HD11 ' A' ' 4' ' ' ILE . 57.2 mmtt -66.81 -40.45 88.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.893 0.378 . . . . 0.0 110.9 179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -69.95 -39.6 75.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.796 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -61.59 -44.71 96.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.988 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.57 ' O ' ' O ' ' A' ' 86' ' ' LYS . 41.9 t -135.98 165.81 24.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.746 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.538 ' O ' ' HD3' ' A' ' 90' ' ' LYS . 11.1 tmtt? 66.91 132.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.134 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -153.35 -109.46 0.38 Allowed Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.614 ' O ' ' CB ' ' A' ' 138' ' ' PHE . 17.8 mtmt -105.08 15.46 27.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.468 0.175 . . . . 0.0 110.774 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.614 ' CB ' ' O ' ' A' ' 137' ' ' LYS . 31.4 t80 91.56 -15.9 0.18 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.539 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.538 ' CG ' ' N ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -92.8 -77.35 0.44 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.446 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.538 ' N ' ' CG ' ' A' ' 139' ' ' LYS . 49.5 mtt180 -136.69 165.55 34.34 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.684 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.525 ' HD2' ' HB3' ' A' ' 140' ' ' ARG . 51.3 Cg_endo -84.85 -11.2 7.92 Favored 'Trans proline' 0 C--N 1.302 -1.908 0 C-N-CA 123.146 2.564 . . . . 0.0 112.439 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.9 m 71.93 -75.9 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.512 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 90.4 mt -119.24 143.19 47.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.613 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.404 ' H ' ' HG2' ' A' ' 144' ' ' ARG . 0.0 OUTLIER -116.18 34.8 4.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.508 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.626 ' C ' ' HD2' ' A' ' 147' ' ' ARG . 99.9 mtt180 -59.93 108.3 0.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.459 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . 0.51 ' C ' ' HD3' ' A' ' 147' ' ' ARG . 10.1 m -83.71 -25.76 7.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.391 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.626 ' HD2' ' C ' ' A' ' 145' ' ' ARG . 0.0 OUTLIER 53.17 -150.57 0.36 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.681 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.546 ' O ' HG23 ' A' ' 148' ' ' ILE . 12.6 tt -38.06 124.79 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.485 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.576 ' O ' ' CB ' ' A' ' 153' ' ' MET . 3.4 m -70.19 103.73 2.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.387 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.499 ' HA ' ' HB3' ' A' ' 153' ' ' MET . . . -59.85 -38.81 83.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.341 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.613 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -45.02 -82.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.435 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . . . -60.41 -35.2 75.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.805 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.601 ' HE2' ' CE1' ' A' ' 27' ' ' PHE . 9.5 ttt -49.74 -52.41 31.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.245 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.753 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 10.7 mtp -71.1 -29.21 64.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.481 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 52.7 mt-30 -60.3 -44.09 95.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.345 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.81 98.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.077 0.465 . . . . 0.0 110.17 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -64.37 -42.13 96.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.642 -179.533 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.448 ' HB3' ' HB2' ' A' ' 161' ' ' ARG . 85.4 mt -88.21 -2.88 58.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.405 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.512 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 49.41 35.96 22.4 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 69.13 45.93 0.85 Allowed 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.593 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.448 ' HB2' ' HB3' ' A' ' 158' ' ' LEU . 4.3 mtp180 -45.6 -35.74 4.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.642 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -154.31 167.4 30.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.647 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -144.9 -164.81 2.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.401 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 85.83 11.55 73.56 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.577 ' O ' ' O ' ' A' ' 166' ' ' HIS . 0.1 OUTLIER -102.44 -88.29 0.39 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.813 0.34 . . . . 0.0 110.765 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.577 ' O ' ' O ' ' A' ' 165' ' ' HIS . 98.3 m-70 37.5 -166.4 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.626 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . 0.455 ' CE1' ' NE2' ' A' ' 168' ' ' HIS . 1.8 p80 -94.5 3.21 55.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.79 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.556 ' O ' ' C ' ' A' ' 169' ' ' HIS . 98.9 m-70 -102.15 -15.64 16.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.655 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . 0.556 ' C ' ' O ' ' A' ' 168' ' ' HIS . 83.7 t60 25.43 -109.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.552 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . 0.516 ' C ' ' O ' ' A' ' 169' ' ' HIS . 12.2 m-70 . . . . . 0 C--O 1.219 -0.534 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.608 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.432 ' O2 ' HD12 ' A' ' 148' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.599 ' CE ' HG21 ' A' ' 79' ' ' VAL . 8.9 mmm . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.515 ' OD2' ' CE1' ' A' ' 5' ' ' TYR . 1.2 m-20 71.71 105.21 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.746 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 45.9 m-20 -62.06 -44.26 97.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.019 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.61 HG23 ' N ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -50.81 -46.75 29.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 121.025 0.44 . . . . 0.0 109.982 179.091 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.698 ' CD1' ' HG2' ' A' ' 83' ' ' ARG . 22.2 m-30 -69.95 -34.0 72.85 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.604 ' HA ' ' CE ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -54.9 -45.61 74.74 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 178.302 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 11' ' ' GLN . . . -65.1 -33.27 75.63 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 176.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.601 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.84 -40.27 83.75 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.877 HG22 HD12 ' A' ' 78' ' ' LEU . 95.1 t -61.98 -46.13 97.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.046 0.45 . . . . 0.0 109.788 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -73.42 -23.78 60.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.452 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 7' ' ' ALA . 3.1 mm-40 -72.03 -38.6 69.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.779 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.76 HD12 HD11 ' A' ' 78' ' ' LEU . 21.5 mt -49.4 118.72 2.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.734 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.657 HG22 ' HB2' ' A' ' 16' ' ' GLN . 8.8 t -56.33 -177.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.374 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.548 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 88.0 tt0 -60.04 -44.01 94.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.434 ' H ' HG23 ' A' ' 13' ' ' THR . 86.5 tt0 -74.0 -51.23 16.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.657 ' HB2' HG22 ' A' ' 13' ' ' THR . 13.0 mt-30 -50.47 -52.76 35.23 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.591 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' A' ' 9' ' ' VAL . 28.0 ttmt -66.18 -35.06 79.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.046 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.548 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 62.2 t30 -59.6 -43.77 93.6 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.199 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.48 ' O ' ' HE3' ' A' ' 154' ' ' MET . 12.6 mt-10 -61.02 -46.92 88.78 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.196 0.522 . . . . 0.0 110.492 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.64 ' O ' ' CZ ' ' A' ' 77' ' ' PHE . 67.4 m-85 -66.15 -38.54 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.224 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -56.5 -42.58 78.57 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.993 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -60.77 -40.86 94.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.915 178.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.866 ' HB2' ' CE ' ' A' ' 154' ' ' MET . . . -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.185 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.675 ' O ' HG22 ' A' ' 28' ' ' VAL . 15.9 t80 -57.32 -48.23 79.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.444 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.609 ' O ' ' N ' ' A' ' 29' ' ' LEU . 64.6 t0 -62.23 -40.02 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.393 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.993 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -57.33 -46.35 85.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.75 179.674 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.791 ' CZ ' ' HE3' ' A' ' 153' ' ' MET . 12.9 m-85 -60.66 -41.32 94.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.459 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.801 HG13 HG12 ' A' ' 36' ' ' ILE . 25.1 m -107.22 25.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.619 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.656 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -56.97 105.93 0.26 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.305 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.49 -9.32 58.94 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.595 ' HB3' ' HB ' ' A' ' 28' ' ' VAL . . . -64.14 129.76 41.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.806 0.336 . . . . 0.0 110.517 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.63 -43.85 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.779 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' A' ' 34' ' ' GLY . 50.2 p30 -80.09 -23.36 41.33 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.834 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.6 ' O ' ' CZ ' ' A' ' 24' ' ' PHE . . . 79.68 1.81 87.32 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.649 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 75.4 p -90.98 135.67 33.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.625 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.832 ' HB ' HG13 ' A' ' 72' ' ' VAL . 96.7 mt -77.6 110.46 13.31 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.101 -179.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.587 ' C ' HD11 ' A' ' 61' ' ' ILE . 1.0 OUTLIER -108.86 -178.58 3.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.05 178.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.611 ' N ' HD11 ' A' ' 61' ' ' ILE . 2.8 p -58.58 -24.23 60.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.516 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -84.46 -48.37 9.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.229 178.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.677 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 60.3 mp0 -71.96 -20.81 61.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.581 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.975 HD22 HD22 ' A' ' 57' ' ' LEU . 10.0 tt -83.2 -49.28 9.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.951 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.553 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -60.15 -38.08 93.87 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.677 ' CG ' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -47.41 -58.22 4.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.731 0.3 . . . . 0.0 110.305 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.834 ' CG2' HG22 ' A' ' 26' ' ' ILE . 3.0 t -62.85 -32.09 54.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.595 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 89.6 mmm -60.19 -42.61 95.43 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.716 ' HA ' ' O ' ' A' ' 50' ' ' GLN . 40.1 mtp180 -67.45 -32.04 72.63 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.637 ' HE2' HG22 ' A' ' 44' ' ' VAL . 26.8 mtm -59.53 -36.65 76.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.881 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.581 HD21 ' HB3' ' A' ' 156' ' ' ALA . 73.4 mt -88.59 -0.79 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.314 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.6 4.15 52.54 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.716 ' O ' ' HA ' ' A' ' 46' ' ' ARG . 25.2 mm100 -90.34 135.27 33.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.972 0.415 . . . . 0.0 110.574 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.557 ' O ' ' OD1' ' A' ' 51' ' ' ASN . 34.1 t-20 -134.11 60.99 48.29 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.892 ' HG2' HD21 ' A' ' 57' ' ' LEU . 60.2 Cg_endo -75.46 149.14 34.48 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.684 2.256 . . . . 0.0 112.41 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.623 ' OG1' ' OE1' ' A' ' 56' ' ' GLU . 62.6 p -81.64 161.68 60.65 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.056 0.455 . . . . 0.0 110.623 178.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 47.1 Cg_exo -54.63 -39.36 89.14 Favored 'Trans proline' 0 C--N 1.303 -1.821 0 C-N-CA 122.71 2.273 . . . . 0.0 111.837 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -62.77 -50.49 70.85 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.154 0.502 . . . . 0.0 110.827 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.623 ' OE1' ' OG1' ' A' ' 53' ' ' THR . 21.9 mp0 -67.94 -39.68 83.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.841 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.975 HD22 HD22 ' A' ' 41' ' ' LEU . 23.0 mt -62.09 -39.37 92.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.754 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -59.43 -40.66 87.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.368 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.34 -49.33 76.01 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.026 0.441 . . . . 0.0 111.203 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.814 ' SD ' HD23 ' A' ' 57' ' ' LEU . 2.3 ptp -64.74 -35.16 80.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.489 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.72 HG12 HD13 ' A' ' 41' ' ' LEU . 1.1 mt -62.63 -46.61 95.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.075 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 13.2 t70 -61.45 -30.22 70.44 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.53 ' CG ' ' NH1' ' A' ' 83' ' ' ARG . 5.3 tp10 -47.1 -37.14 9.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.283 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 76' ' ' GLU . 1.5 m -114.52 -16.3 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.662 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.564 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 38.8 t70 -88.25 78.31 8.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.47 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.563 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 1.1 tt0 -72.77 -11.65 60.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.782 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -75.53 -12.13 60.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.532 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.29 14.07 68.38 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 85.7 p -85.1 -6.41 59.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.783 0.325 . . . . 0.0 110.713 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.535 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 71.51 17.88 76.66 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.529 -1.028 . . . . 0.0 110.529 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.649 ' HB ' ' HB2' ' A' ' 35' ' ' SER . 0.9 OUTLIER -138.45 124.12 19.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.934 0.397 . . . . 0.0 110.76 -179.636 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.832 HG13 ' HB ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -90.12 117.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.421 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.51 ' N ' ' HB2' ' A' ' 76' ' ' GLU . 45.3 p-10 -82.26 -168.12 1.85 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.609 179.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.98 ' HE1' HD23 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -56.84 -51.06 70.48 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.714 -179.521 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.67 -42.59 95.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.899 179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.604 ' OE1' ' HA ' ' A' ' 72' ' ' VAL . 46.4 mt-10 -64.49 -42.05 96.09 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.109 0.48 . . . . 0.0 110.575 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.731 ' N ' HG23 ' A' ' 72' ' ' VAL . 0.0 OUTLIER -70.29 -43.19 70.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.797 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.98 HD23 ' HE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.92 -37.79 61.15 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.599 HG21 ' CE ' ' A' ' 1' ' ' MET . 39.7 t -61.56 -45.87 97.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 121.162 0.506 . . . . 0.0 110.42 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.714 ' HG2' ' N ' ' A' ' 81' ' ' MET . 2.5 ptm -53.6 -36.88 62.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.305 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.714 ' N ' ' HG2' ' A' ' 80' ' ' MET . 24.7 mmt -66.55 -50.0 64.6 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.198 0.523 . . . . 0.0 110.494 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.668 ' CG2' ' CD2' ' A' ' 5' ' ' TYR . 0.2 OUTLIER -68.43 -28.07 39.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.306 179.299 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.698 ' HG2' ' CD1' ' A' ' 5' ' ' TYR . 21.0 mtp180 -61.48 -46.41 90.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.505 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.1 m -75.65 -34.65 60.52 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.307 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.614 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 75.8 mtm -63.81 -41.35 97.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.95 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.577 ' O ' ' C ' ' A' ' 87' ' ' ASP . 0.1 OUTLIER -71.38 -42.67 68.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.698 -179.208 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.577 ' C ' ' O ' ' A' ' 86' ' ' LYS . 5.6 p-10 22.18 75.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.412 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.639 ' O ' ' C ' ' A' ' 89' ' ' SER . 99.1 m-20 -61.11 -40.14 92.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.731 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.639 ' C ' ' O ' ' A' ' 88' ' ' ASP . 23.5 m 8.54 -102.07 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 O-C-N 123.461 0.476 . . . . 0.0 110.707 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -129.83 -88.8 0.5 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.653 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 137' ' ' LYS . . . 74.31 -156.89 50.51 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 136' ' ' GLY . 0.0 OUTLIER 81.7 -88.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 110.655 -179.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.447 ' H ' ' HB3' ' A' ' 137' ' ' LYS . 77.9 m-85 -98.29 5.07 48.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.834 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.573 ' O ' ' O ' ' A' ' 140' ' ' ARG . 3.2 mmmt -125.34 62.28 1.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.511 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.573 ' O ' ' O ' ' A' ' 139' ' ' LYS . 5.2 ptp85 47.59 171.67 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.144 0.497 . . . . 0.0 110.46 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.708 ' O ' ' CB ' ' A' ' 142' ' ' THR . 23.3 Cg_exo -64.09 -51.36 2.23 Favored 'Trans proline' 0 C--N 1.302 -1.873 0 C-N-CA 122.886 2.39 . . . . 0.0 112.482 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.708 ' CB ' ' O ' ' A' ' 141' ' ' PRO . 2.5 m 137.16 154.26 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 123.782 0.676 . . . . 0.0 110.141 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.677 ' CB ' ' O ' ' A' ' 142' ' ' THR . 86.5 mt 101.11 130.2 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.14 0 O-C-N 123.992 0.807 . . . . 0.0 110.658 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 58.3 ttp85 -161.49 -52.63 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.306 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 13.5 mtp-105 -151.79 21.01 0.7 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.785 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . 1.003 HG12 ' HG3' ' A' ' 147' ' ' ARG . 88.4 t -130.76 136.6 57.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.76 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 1.003 ' HG3' HG12 ' A' ' 146' ' ' VAL . 0.0 OUTLIER 70.72 146.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.456 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.574 HD12 ' SD ' ' A' ' 45' ' ' MET . 18.7 tt -53.76 127.84 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.415 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.65 ' O ' ' CB ' ' A' ' 153' ' ' MET . 68.4 m -67.37 92.91 0.3 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.254 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -50.04 -34.09 20.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.514 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.534 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 0.0 OUTLIER -62.17 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.229 0.537 . . . . 0.0 110.891 179.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 155' ' ' GLN . . . -60.46 -30.92 69.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.554 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.791 ' HE3' ' CZ ' ' A' ' 27' ' ' PHE . 2.3 ttt -50.96 -54.5 23.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.652 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' MET . . . . . 0.866 ' CE ' ' HB2' ' A' ' 23' ' ' ALA . 1.9 mtp -65.77 -31.84 73.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.193 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' A' ' 151' ' ' ASP . 74.3 mt-30 -60.69 -41.47 95.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.882 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . 0.581 ' HB3' HD21 ' A' ' 48' ' ' LEU . . . -63.57 -39.89 95.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.095 0.474 . . . . 0.0 110.267 178.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.688 HD22 HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -71.6 -48.08 50.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.27 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' A' ' 22' ' ' ALA . 91.9 mt -70.62 -40.07 73.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.777 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . 0.757 ' O ' ' HB3' ' A' ' 160' ' ' ALA . . . 83.95 12.83 76.21 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 111.051 -0.819 . . . . 0.0 111.051 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.757 ' HB3' ' O ' ' A' ' 159' ' ' GLY . . . 89.88 61.05 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.808 0.337 . . . . 0.0 110.631 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . 0.761 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 34.2 mtp180 -93.17 -171.6 2.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.53 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.761 ' HB3' ' O ' ' A' ' 161' ' ' ARG . . . 90.92 107.85 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.51 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -75.58 136.09 40.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.452 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.17 -166.23 53.68 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 1.5 t60 56.96 87.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.815 0.341 . . . . 0.0 110.62 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 167' ' ' HIS . 92.8 m-70 -61.78 -41.1 97.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.384 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 166' ' ' HIS . 1.3 t60 173.58 -155.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.544 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.538 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 52.6 t-80 -101.57 23.14 11.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.552 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -156.9 168.07 28.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.566 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.449 179.814 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' V8Y . . . . . 0.532 ' O2 ' ' SD ' ' A' ' 60' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_